TY - CONF
A1 - Pauw, Brian Richard
T1 - Reimagining user-driven science
N2 - The materials scientists we work with do not want (or need) to learn the ways of the scatterer; they are primarily interested in obtaining trustworthy, authoritative answers. In particular, they need structural understanding in light of the wider framework of their experiment(s). Our interest, therefore, lies in helping them attain this this interconnected understanding, while using such investigations to further hone our methodology to approximate perfection.
While perfection is by definition an unattainable goal, we have spent the last 15+ years exploring and expanding on many of its constituent aspects (often together with likeminded people) [1]. These aspects include:
developing various visualization and simulation tools,
deconstructing data corrections and uncertainty estimation,
advancing analysis methods,
quantifying questions on traceability, documentation,
reproducible automation of synthesis-, measurement- and data pipelines,
data visualization, exploration and education,
and many more…
As we explored these individual aspects, it has become clear that high quality output demands involving ourselves in the entire experimental workflow, with all associated aspects. This allows you to establish trustworthy links between parameters, structure, and performance. Through multiple cross-checks and validations, we can furthermore assign a degree of confidence to our findings. This is what we call the holistic approach.
This talk will briefly define perfection in scattering experiments, expand on the holistic approach, and show examples to demonstrate its benefits.
T2 - Invited talk - special event
CY - Trieste, Italy
DA - 15.05.2025
KW - X-ray scattering
KW - Holistic experiments
KW - Laboratory management
KW - Laboratory automation
KW - Data stewardship
KW - User support
PY - 2025
AN - OPUS4-63372
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Pauw, Brian Richard
T1 - and now it's bigger…: setting up for large scale experimentation
N2 - In our laboratory, we rely heavily on automation for synthesis and measurement. Done right, automation can deliver reliable quantities of excruciatingly detailed data, produced in a reproducible and traceable way. This data then needs sorting and organising, and a good structure of metadata is a good start to long-lasting data.
This metadata collection is an essential part of our “holistic experimentation”-approach. In this approach, we try to ensure that all aspects of the experimental chain are performed to a high standard, so that experimental integrity is maintained. In other words: as a failure in one of the components of the chain can make an entire experiment worthless, we must ensure each component is done (and documented) well.
In this talk, we show how we 1) synthesise well-documented sample series, 2) apply a complete end-to-end X-ray scattering characterisation methodology to those samples, and 3) can link the data from the synthesis to the structural details obtained from the scattering experiments in a visual dashboard. Furthermore, we will show examples on how data can be organised in hierarchical structures in HDF5-based datafiles, and how this helps move towards more trustworthy, traceable science.
T2 - Future Labs Live 2025
CY - Basel, Switzerland
DA - 27.05.2025
KW - Lab automation
KW - Holistic experiments
KW - Synthesis
KW - Traceability
KW - Data stewardship
PY - 2025
AN - OPUS4-63373
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Monroy, José del Refugio
A1 - Deshpande, Tejas
A1 - Schlecht, Joël
A1 - Douglas, Clara
A1 - Stirling, Robbie
A1 - Grabicki, Niklas
A1 - Smales, Glen Jacob
A1 - Kochovski, Zdravko
A1 - Fabozzi, Filippo Giovanni
A1 - Hecht, Stefan
A1 - Feldmann, Sascha
A1 - Dumele, Oliver
T1 - Homochiral versus racemic 2D covalent organic frameworks
N2 - The synthesis of homochiral two-dimensional covalent organic frameworks (2D COFs) from chiral π-conjugated building blocks is challenging, as chiral units often lead to misaligned stacking interactions. In this work, we introduce helical chirality into 2D COFs using configurationally stable enantiopure and racemic [5]helicenes as linkers in the backbone of 2D [5]HeliCOFs as powders and films. Through condensation with 1,3,5-triformylbenzene (TFB) or 1,3,5-triformylphloroglucinol (TFP), our approach enables the efficient formation of a set of homochiral and racemic 2D [5]HeliCOFs. The resulting carbon-based crystalline and porous frameworks exhibit distinct structural features and different properties between homochiral and racemic counterparts. Propagation of helical chirality into the backbone of the crystalline frameworks leads to the observation of advanced chiroptical properties in the far-red visible spectrum, along with a less compact structure compared with the racemic frameworks. Homogeneous thin films of [5]HeliCOFs disclosed photoluminescent properties arising from the controlled growth of highly ordered π-conjugated lattices. The present study offers insight into general chiral framework formation and extends the Liebisch−Wallach rule to 2D COFs.
KW - Chirality
KW - Covalent organic frameworks
KW - Diffraction
KW - Lattices
KW - Thin films
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-633755
DO - https://doi.org/10.1021/jacs.5c01004
SN - 0002-7863
VL - 147
IS - 21
SP - 17750
EP - 17763
PB - American Chemical Society (ACS)
CY - Washington, DC
AN - OPUS4-63375
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Khropost, Diana
A1 - Riethmüller, Franziska
A1 - Döhring, Thorsten
A1 - Flachs, Dennis
A1 - Hülagü, Deniz
A1 - Hertwig, Andreas
A1 - Cotroneo, Vincenzo
A1 - gibertini, eugenio
T1 - Polydopamine – a bio-inspired polymer for X-ray mirror coatings and other technical applications
N2 - Although the organic molecule dopamine (3,4-dihydroxyphenethylamine) is commonly known as one of the “hormones of happiness”, thin polymer films of polydopamine (PDA) also have interesting technical properties. PDA is a very strong glue that sticks on almost everything, even under water. In nature, PDA is found in the byssal thread cuticles of mussels. When produced by dip-coating, the self-organizing PDA layers grow in a reproducible thickness of single or multiple molecule monolayers of a few nanometres thickness only. Here we present an optimized preparation regime as derived from polymerization analysis through absorption spectroscopy. One application is the use of thin PDA overcoatings to increase the soft X-ray reflectivity of astronomical X-ray mirrors. Furthermore, we give an outlook to other technical applications for this interesting material, presenting this bio-inspired organic polymer as an innovative technical solution for the future, with applications such as PDA-based super-capacitors and its promising role in enhancing separator materials for batteries.
T2 - SPIE Optics + Optoelectronics 2025
CY - Prague, Czech Republic
DA - 07.04.2025
KW - X-ray mirrors
KW - Reflectivity
KW - Polydopamine
KW - Ellipsometry
PY - 2025
DO - https://doi.org/10.1117/12.3056298
VL - 13531
SP - 1
EP - 11
PB - SPIE
AN - OPUS4-63630
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Khropost, Diana
A1 - Riethmüller, Franziska
A1 - Stanik, Eva
A1 - Döhring, Thorsten
A1 - Hertwig, Andreas
A1 - Hülagü, Deniz
T1 - Polydopamine -a bionic material and its potential applications for batteries
N2 - Polydopamine (PDA) recently came into focus as an innovative material for applications in various technical fields. It is a very strong glue that sticks on almost everything, even under water: In nature, PDA is found in the byssal thread cuticles of mussels. In 2007, Lee et al. first showed that dipping substrates into a solution of dopamine results in the formation of thin PDA films on numerous materials. The simple preparation and the high durability of these coatings have stimulated growing research interest and a wide variety of applications in energy, biomedical and environmental science, and other fields.
We have investigated thin layers of PDA with different methods including ellipsometry, tactile measurements of the layer thickness and in situ absorption measurements during the polymerization process. During polymerization the dopamine solution shows a progressive colour change from transparent to brown that has been monitored by spectrometric measurements. The increasing absorption of the cuvette with dopamine solution can be seen in figure 1. The absorption levels off after approximately 2,5 h of polymerization time, thus indicating termination of the primary formation of the PDA film. This data shows that for homogeneous layer growth it is advantageous to interrupt the process after two hours. To generate a higher layer thickness, the samples need to be cleaned and immersed in a fresh dopamine solution subsequently. In addition, ellipsometry measurements on polydopamine layers could determine the corresponding coating thickness as well as its complex refractive index over a broad wavelength range.
T2 - Materials Week 2025
CY - Frankfurt am Main, Germany
DA - 02.04.2025
KW - Polydopamine
KW - Ellipsometry
KW - Leyer thickness
PY - 2025
AN - OPUS4-63636
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Nikitin, D.
A1 - Biliak, K.
A1 - Protsak, M.
A1 - Adejube, B.
A1 - Ali-Ogly, S.
A1 - Škorvanková, K.
A1 - Červenková, V.
A1 - Katuta, R.
A1 - Tosco, M.
A1 - Hanuš, J.
A1 - Černochová, Z.
A1 - Černoch, P.
A1 - Štěpánek, P.
A1 - Boiko, O.
A1 - Szymoniak, Paulina
A1 - Schönhals, Andreas
A1 - Faupel, F.
A1 - Biedermann, H.
A1 - Vahl, A.
A1 - Choukourov, A.
T1 - Unveiling the Fundamental Principles of Reconfigurable Resistance States in Silver/Poly(ethylene glycol) Nanofluids
N2 - Developing novel memristive systems aims to implement key principles of biological neuron assemblies – plasticity, adaptivity, and self-organization – into artificial devices for parallel, energy-efficient computing. Solid-state memristive devices, such as crossbar arrays and percolated nanoparticle (NP) networks, already demonstrate these properties. However, closer similarity to neural networks is expected from liquid-state systems, including polymer melts, which remain largely unexplored. Here, the resistive switching in silver/poly(ethylene glycol) (Ag/PEG) nanofluids, prepared by depositing gas-aggregated Ag NPs into PEGs of varying molecular mass, is investigated.
These systems form long-range conductive NP bridges with reconfigurable resistance states in response to an electric field. The zeta-potential of Ag NPs and molecular mobility of PEG determine the prevalence of low resistance (ohmic) state, high resistance states (poor conductance) or intermediate transition states governed by space-charge-limited conduction or electron tunneling. The occurrence of these states is given by the interparticle gaps, which are determined by the conformation of PEG molecules adsorbed on the NPs. It is presented, for the first time, an equivalent circuit model for the Ag/PEG system. These findings pave the way to adopt polymer melts as matrices for neuromorphic engineering and bio-inspired electronics.
KW - Nanofluids
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-635351
DO - https://doi.org/10.1002/advs.202505103
VL - 12
SP - 1
EP - 14
PB - Wiley
AN - OPUS4-63535
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Schlögl, Johanna
A1 - Krappe, Alexander R.
A1 - Fürstenwerth, Paul C.
A1 - Brosius, Amelie L.
A1 - Fasting, Carlo
A1 - Hoffmann, Kurt F.
A1 - Resch-Genger, Ute
A1 - Eigler, Siegfried
A1 - Steinhauer, Simon
A1 - Riedel, Sebastian
T1 - Luminescent Perhalofluoro Trityl Radicals
N2 - In this proof-of-concept study, we show that polyfluorinated trityl radicals with the, to this date, highest fluorination grade can be accessed in quantitative yields in a straightforward manner starting from the perfluorinated trityl cation. The trityl skeleton is functionalized with trimethylsilyl halides to yield perhalofluoro trityl cations, which are subsequently reduced using commercial zinc powder. In this way, we prepare three perhalofluoro trityl radicals and analyze the impact of the fluorine ligands on their electro-optical properties, revealing some interesting trends. In comparison to literature-known polychlorinated trityl radicals, the new polyfluorinated derivatives exhibit substantially higher fluorescence quantum yields, longer luminescence lifetimes, and an expanded emission range that extends into the yellow spectral region. They further display enhanced photostability under light irradiation. In radical-stained polystyrene nanoparticles, an additional broad emission band in the red−NIR wavelength region is observed, which is attributed to excimer formation. Finally, the stability of the new radicals is investigated under ambient conditions, showing the slow conversion with atmospheric oxygen yielding the respective peroxides, which are characterized by single-crystal X-ray diffraction. All in all, our study extends the present scope of luminescent trityl radicals, as the functionalization of the perfluorinated cationic precursor unlocks the path toward a vast variety of polyfluorinated trityl radicals.
KW - Dye
KW - Fluorescence
KW - Radical
KW - Synthesis
KW - Mechanism
KW - Signal enhancement
KW - Nano
KW - Particle
KW - Characterization
KW - Quantum yield
KW - Photophysics
KW - Lifetime
KW - Polarity
KW - Polymer
KW - Solvatchromism
KW - Excimer
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-647973
DO - https://doi.org/10.1021/jacs.5c16418
SN - 0002-7863
VL - 147
IS - 46
SP - 1
EP - 8
PB - American Chemical Society (ACS)
AN - OPUS4-64797
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - GEN
A1 - Resch-Genger, Ute
A1 - Abram, Sarah-Luise
A1 - Tavernaro, Isabella
A1 - Zou, Shan
A1 - Johnston, Linda
T1 - Behind the Paper: Nanoscale Reference and Test Materials for the Validation of Characterization Methods for Engineered Nanomaterials – Current State, Limitations and Needs
N2 - Engineered nanomaterials (NMs) of different material composition, morphology, and surface chemistry are widely used in material and life sciences. For NM quality control and risk assessment, NM key properties must be characterized with validated methods, requiring reference materials (RMs).
KW - Engineered Nanomaterials
KW - Nanoscale reference materials
KW - Interlaboratory comparisons
KW - Traceability
KW - Standardization and Regulation
KW - Nano
KW - Particle
KW - Quality assurance
KW - Surface chemistry
PY - 2025
UR - https://communities.springernature.com/posts/nanoscale-reference-and-test-materials-for-the-validation-of-characterization-methods-for-engineered-nanomaterials-current-state-limitations-and-needs
SP - 1
EP - 3
PB - Springer Nature
CY - Online
AN - OPUS4-62572
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Haroun, A. A. A.
A1 - Derbala, H. A.
A1 - Bassioni, G.
A1 - Resch-Genger, Ute
A1 - Shafik, E. S.
A1 - Hassan, A. M. A.
T1 - N-aminophthalimide as a novel UV-stabilizer to promote physico-mechanical properties of highdensity polyethylene (HDPE)
N2 - This study aimed to evaluate the efficacy of Naminophthalimide (NAP) as a novel UV-stabilizer for highdensity polyethylene (HDPE) in improving its physicomechanical properties under UV exposure. NAP was synthesized by interaction between phthalimide and hydrazine hydrate. It was incorporated into HDPE with different weight ratios (1, 1.5, 2, and 3%), and its performancewas compared with Hostavin as a traditional UV stabilizer. The HDPE composites were exposed to UV irradiation for different periods (7 and 14 days) to evaluate their photodegradation behavior. Tensile strength, elongation at break were assessed before and after UV exposure. Also, oxidation induction time (OIT), melt flow rate (MFR), Vicat softening temperature were evaluated. Hostavin incorporation reduced tensile strength from 22.36 to 20.62MPa at higher concentrations. It has been found that 3% Hostavin, significantly improved elongation at break, increasing from 423% to 1,170%, suggesting enhanced flexibility. In contrast, NAP increased tensile strength to 22.9MPa and moderately enhanced elongation but slightly declined at 3%due to potential over-stabilization. Under UV exposure, retained tensile strength and elongation was improved with stabilizer content, which increasing tensile strength retention. The HDPE that containing NAP showed enhanced UV resistance and superior retention of mechanical properties compared to Hostavin.
KW - Polymer
KW - Advanced materials
KW - Quality assurance
KW - Stabilizer
KW - Synthesis
KW - Physico-mechanical properties
PY - 2025
DO - https://doi.org/10.1515/polyeng-2024-0262
SN - 2191-0340
SP - 1
EP - 8
PB - De Gruyter
CY - Berlin
AN - OPUS4-63534
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Resch-Genger, Ute
T1 - Reliable Photoluminescence Quantum Yields – New Reference Materials and Interlaboratory Comparisons
N2 - The rational design and choice of molecular and nanoscale reporters, the comparison of different emitter classes, and photophysical and mechanistic studies require quantitative photoluminescence measurements and the reliable determination of the key performance parameter photoluminescence quantum yield (QY), i.e., the number of emitted per absorbed photons. This is of special importance for all photoluminescence applications in the life and material sciences in the UV/vis/NIR/SWIR. To improve the reliability and comparability of photoluminescence and QY measurements across laboratories, pitfalls, achievable uncertainties, and material-specific effects related to certain emitter classes must be explored. Also, suitable protocols and reference materials are needed which have been validated in interlaboratory comparisons for different wavelength regions and transparent and scattering luminophores.[1]
Based on absolute and relative photoluminescence measurements of functional dyes and luminescent nanomaterials, reliable methods for determining QY of transparent and scattering luminophores, nonlinear emitters, and solid luminescent nanomaterials have been developed.[1-4] Thereby, material- and method-related uncertainties of relative and absolute QY measurements and achievable uncertainties could be quantified for linear and nonlinear UV/vis/NIR/SWIR emitters and lately for also luminescent and scattering materials and solid phoshors.
In this context, we present the development and certification of a first set of UV/vis/NIR quantum yield standards with a complete uncertainty budget,[5] which present simple tools for a better comparability of QY measurements. In addition, a first interlaboratory comparison of absolute QY measurements of solid and scattering LED converter materials with integrating sphere spectroscopy has been performed.[5] The outcome of this study is presented, thereby addressing common pitfalls and measurement uncertainties and providing recommendations for the performance of reliable QY measurements of linear and non-linear emitters in transparent, scattering, and solid samples.
T2 - Anakon 2025
CY - Leipzig, Germany
DA - 10.03.2025
KW - Quality assurance
KW - Reference material
KW - Method
KW - Fluorescence
KW - Quantum yield
KW - Absolute
KW - Integrating sphere spectroscopy
KW - Interlaboratory comparison
KW - Dye
KW - Film
KW - Nano
KW - Particle
KW - Scattering
KW - Uncertainty
KW - LED converter
PY - 2025
AN - OPUS4-62792
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Osiopova, Viktoriia
A1 - Tavernaro, Isabella
A1 - Ge, L.
A1 - Kitzmann, W. R.
A1 - Heinze, K.
A1 - Reithofer, M. R.
A1 - Resch-Genger, Ute
T1 - Complete protection of NIR-luminescent molecular rubies from oxygen quenching in air by L-arginine-mediated silica nanoparticles
N2 - The application of emerging luminophores such as near-infrared (NIR) emissive complexes based on earth-abundant chromium as central ion and triplet-triplet annihilation upconversion (TTA-UC) systems in air as optical reporters for bioimaging or photonic materials for energy conversion requires simple and efficient strategies for their complete protection from uminescence quenching by oxygen. Therefore, we explored the influence of sol–gel synthesis routes on the oxygen protection efficiency of the resulting core and core/shell silica nanoparticles (SiO2 NPs), utilizing the molecular ruby-type luminophores CrPF6 ([Cr(ddpd)2](PF6)3; ddpd = N,N'-dimethyl-N,N'-dipyridin-2-ylpyridin-2,6-diamine) and CrBF4 ([Cr(ddpd)2](BF4)3) with their oxygendependent, but polarity-, proticity-, viscosity-, and concentration-independent luminescence as optical probes for oxygen permeability. The sol–gel chemistry routes we assessed include the classical Stöber method and the underexplored Larginine approach, which relies on the controlled hydrolysis of tetraethoxysilane (TEOS) in a biphasic cyclohexane/water system with the catalyst L-arginine. As demonstrated by luminescence measurements of air- and argon-saturated dispersions of CrPF6- and CrBF4-stained SiO2 NPs of different size and particle architecture, utilizing the luminescence decay kinetics of argon-saturated solutions of CrPF6 and CrBF4 in acetonitrile (ACN) as benchmarks, only SiO2 NPs or shells synthesized by the L-arginine approach provided complete oxygen protection of the CrIII complexes under ambient conditions. We ascribe the different oxygen shielding efficiencies of the silica networks explored to differences in density and surface chemistry of the resulting nanomaterials and coatings, leading to different oxygen permeabilities. Our Larginine based silica encapsulation strategy can open the door for the efficient usage of oxygen-sensitive luminophores and TTA-UC systems as optical reporters and spectral shifters in air in the future.
KW - Quality assurance
KW - Fluorescence
KW - Quantification
KW - Advanced materials
KW - Nano
KW - Quantum yield
KW - NIR
KW - Characterization
KW - Electron microscopy
KW - Silica
KW - Synthesis
KW - Oxygen sensing
KW - Surface
KW - Doping
KW - Lifetime
KW - Cr(III) complex
KW - Shielding
KW - Sensing
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-638271
DO - https://doi.org/10.26599/NR.2025.94907241
SN - 1998-0000
VL - 18
IS - 3
SP - 1
EP - 13
PB - SciOpen
AN - OPUS4-63827
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Resch-Genger, Ute
T1 - Reliable measurements of the photoluminescence quantum yield of transparent and scattering luminophores
N2 - Optical measurements of transparent solutions of organic dyes and semiconductor quantum dots and scattering materials such as luminescent nanocomposites and microparticles and phosphors dispersed in liquid and solid matrices play an important role in energy conversion, solid-state lighting, medical diagnostics, and security barcoding. A key performance parameter is the photoluminescence quantum yield QY, i.e., the number of emitted per number of absorbed photons. QY of transparent luminophore solutions can be obtained relative to a fluorescence QY standard of known QY.[1] Meanwhile, a first set of certified fluorescence QY standards is available.[2] Such relative QY measurements require a calibrated spectrofluorometer.[1,3] For determining QY of scattering liquid and solid samples, absolute measurements of QY with a calibrated integrating sphere setup are mandatory.[1,4,5] However, scattering QY standards are not available and uncertainties of such measurements have not yet been assessed in interlaboratory comparisons (ILCs).
To determine typical sources of uncertainty of absolute QY measurements, we assessed the influence of the measurement geometry and the optical properties of the blank for determining the number of incident photons absorbed by the sample in an ILC using commercial integrating sphere setups and a custom-designed integrating sphere setup. Samples examined included transparent and scattering dye solutions, solid phosphors such as YAG:Ce optoceramics used as LED converter material, and polymer films stained with different amounts of phosphor microparticles. Matching QY values could be obtained for transparent dye solutions and scattering dispersions with a blank with scattering properties closely matching those of the sample, while QY measurements of optoceramic samples with different blanks revealed substantial differences of more than 20 %. Based on our data, we recommend non-absorbing blank materials with a high reflectivity (>95 %) such as a 2 mm-thick PTFE target placed on the sample holder as blanks.
T2 - eMRS 2025 Fall Meeting
CY - Warsaw, Poland
DA - 15.09.2025
KW - Quality assurance
KW - Fluorescence
KW - Nano
KW - Particle
KW - Advanced material
KW - Synthesis
KW - Characterization
KW - Fluorescence quantum yield
KW - Phosphor
KW - Absolute
KW - Integrating sphere spectroscopy
KW - Dye
KW - Standardization
KW - Reference material
KW - Interlaboratory comparison
KW - Uncertainty
PY - 2025
AN - OPUS4-64184
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Soyka, J. P.
A1 - Witte, J. F.
A1 - Wiesner, A.
A1 - Krappe, A. R.
A1 - Wehner, D.
A1 - Alnicola, N.
A1 - Paulus, B.
A1 - Resch-Genger, Ute
A1 - Eigler, S.
T1 - [3]Radialene Fluorophores with pH-Switchable Emission and Stable Absorption Maxima
N2 - The first push–pull quino [3]radialene fluorescent dye is reported. Herein, the novel bis(dicyanomethylene)-[3]radialene electron acceptor is connected to a benzimidazole donor. With protonation, a substantial redshift of fluorescence wavelength is observed, while the absorption maximum remains stable. This process is accompanied with an increased fluorescence quantum yield to about 70%. Further, the findings are explained by a combined experimental and theoretical approach, and it is found that vibronic coupling plays a crucial role. This study highlights the yet unexplored potential of [3]radialene-based motifs for the design of environment-responsive fluorophores.
KW - DADQ
KW - Nanographene
KW - fluorescence
KW - Nano
KW - Particle
KW - Synthesis
KW - Characterization
KW - Advanced material
KW - Quantum yield
KW - Photophysic
KW - pH
KW - Probe
KW - Sensor
KW - Lifetime
KW - Polarity
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-642147
DO - https://doi.org/10.1002/ejoc.202500669
SN - 1099-0690
SP - 1
EP - 6
PB - Wiley-VCH
CY - Weinheim
AN - OPUS4-64214
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Weinel, Kristina
A1 - Hahn, Marc Benjamin
A1 - Lubk, Axel
A1 - González Martínez, Ignacio Guillermo
A1 - Büchner, Bernd
A1 - Agudo Jácome, Leonardo
T1 - Nanoparticle Synthesis by Precursor Irradiation with Low-Energy Electrons
N2 - Nanoparticles (NPs) and their fabrication routes are intensely studied for their wide range of application in optics, chemistry, and medicine. Γ-ray and ion irradiation of precursor matter are established methods that facilitate tailored NP synthesis without complicated chemistry. Here, we develop and explore NP synthesis based on irradiating precursor microparticles with low-energy electron beams. We specifically demonstrate the fabrication of plasmonic gold nanoparticles of sizes between 3 and 350 nm on an amorphous SiOx substrate using a 30 kV electron beam. By detailed comparison with electron scattering simulations and thermodynamic modeling, we reveal the dominant role of inelastic electron–matter interaction and subsequent localized heating for the observed vaporization of the precursor gold microparticles. This general principle suggests the suitability of electron-beam irradiation for synthesizing NPs of a wide class of materials.
KW - Gold Nanoparticle
KW - Scanning Electron Microscopy
KW - In situ irradiation
KW - Thermodynamic modelling
KW - Heat Transfer
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-627609
DO - https://doi.org/10.1021/acsanm.4c06033
SN - 2574-0970
VL - 8
IS - 10
SP - 4980
EP - 4988
PB - ACS Publications
CY - Washington, DC
AN - OPUS4-62760
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Feng, Wen
A1 - Schulz, Johannes
A1 - Wolf, Daniel
A1 - Pylypenko, Sergii
A1 - Gemming, Thomas
A1 - Weinel, Kristina
A1 - Agudo Jácome, Leonardo
A1 - Büchner, Bernd
A1 - Lubk, Axel
T1 - Secondary electron emission from gold microparticles in a transmission electron microscope: comparison of Monte Carlo simulations with experimental results
N2 - We measure the electron beam-induced current to analyze the electron-induced secondary electron (SE) emission from micron-sized gold particles illuminated by 80 and 300 keV electrons in a transmission electron microscope. A direct comparison of the experimental and simulated SE emission (SEE) employing Monte Carlo scattering simulations based on the GEANT4 toolkit yields overall good agreement with a noticeable discrepancy arising from the shortcoming of the GEANT4 scattering cross sections in the low-loss regime. Thus, the electron beam-induced current analysis allows to quantify the inelastic scattering including SEE in the transmission electron microscope and provides further insight into the charging mechanisms.
KW - Electron beam-induced current
KW - Transmission electron microscopy
KW - Secondary electron emission
KW - Secondary electron yield
KW - Gold micronoparticle
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-622557
DO - https://doi.org/10.1088/1361-6463/ad9840
VL - 58
IS - 8
SP - 1
EP - 7
PB - IOP Publishing
CY - Bristol, GB
AN - OPUS4-62255
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Agudo Jácome, Leonardo
T1 - In situ electron-beam 'melting' (sublimation) of gold microparticles in the SEM
N2 - Gold micro particles have been modified in the past using the high power density of a localized electron beam of acceleration voltages above 100 kV as an energy source to transform matter at the sub-micron scale in a transmission electron microscope uses. Here, the e-beam-induced transformation of precursor microparticles employing a low-energy e-beam with an acceleration voltage of 30 kV in a scanning electron microscope is implemented. Under these conditions, the technique can be classified between e-beam lithography, where the e-beam is used to mill holes in or grow some different material onto a substrate, and e-beam welding, where matter can be welded together when overcoming the melting phase. Modifying gold microparticles on an amorphous SiOx substrate reveals the dominant role of inelastic electron-matter interaction and subsequent localized heating for the observed melting and vaporization of the precursor microparticles under the electron beam. Monte-Carlo scattering simulations and thermodynamic modeling further support the findings.
T2 - IKZ International Fellowship Award & Summer School 2025 from May 5 to 7, 2025
CY - Berlin, Germany
DA - 05.05.2025
KW - Gold Nanoparticle
KW - Scanning Electron Microscopy
KW - In situ irradiation
KW - Thermodynamic modelling
KW - Heat Transfer
PY - 2025
AN - OPUS4-63256
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Andresen, Elina
T1 - Towards Development of Reference Test Materials for Metrology in Nanomedicine
N2 - The EPM-project “MetrINo” responds to the immediate metrological needs expressed by industry, regulators and policy makers for the development and validation of traceable measurement methods and reference materials (RMs) candidates for the assessment of CQAs of nanotherapeutics. The conference talk focuses on the preparation, homogeneity and stability studies of iron oxide and multi-element nanoparticles as candidate reference materials for size measurements. The developed materials aim to support the development and harmonization of traceable methodologies for nanoparticle characterization.
T2 - NME 2025
CY - Barcelona, Spain
DA - 27.05.2025
KW - IONPs
KW - Reference materials
KW - Lanthanide-based upconverting nanoparticles
PY - 2025
AN - OPUS4-63905
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Abram, Sarah-Luise
A1 - Tavernaro, Isabella
A1 - Resch-Genger, Ute
A1 - Johnston, L. J.
A1 - Zou, S.
T1 - Nanoscale reference and test materials for the validation of characterization methods for engineered nanomaterials — current state, limitations, and needs
N2 - The rational design of engineered nanomaterials (NMs) with improved functionality and their increasing industrial application requires reliable, validated, and ultimately standardized characterization methods for their application-relevant, physicochemical key properties such as size, size distribution, shape, or surface chemistry. This calls for nanoscale (certified)
reference materials (CRMs; RMs) and well-characterized reference test materials (RTMs) termed also quality control (QC) samples, assessed, e.g., in interlaboratory comparisons, for the validation and standardization of commonly used characterization methods. Thereby, increasing concerns regarding potential risks of NMs are also addressed and the road for safe and
sustainable-by-design concepts for the development of new functional NMs and their use as nanomedicines is paved. With this respect, we will provide an overview of relevant international standardization and regulatory activities, definitions, and recommendations on characterization methods and review currently available organic or inorganic nanoscale CRMs, RMs, and RTMs, including their characterization or certification. In addition, we will highlight typical applications to streamline the regulatory approval process and improve manufacturability including the special challenges imposed by the colloidal nature and sometimes limited stability of NMs. Subsequently, we will critically assess the limitations of currently available nanoscale RMs and RTMs and address the gaps to be filled in the future such as the availability of NMs that come with reference data on properties other than commonly addressed particle size, such as surface chemistry or particle number concentration, or
more closely resemble commercially available formulations or address application-relevant matrices.
KW - Nano
KW - Particle
KW - Silica
KW - Quality assurance
KW - Reference material
KW - Review
KW - Surface chemistry
KW - Size
KW - Shape
KW - Particle number concentration
KW - Lipid nanoparticles
KW - Metal nanoparticles
KW - Liposomes
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-625746
DO - https://doi.org/10.1007/s00216-024-05719-6
SN - 1618-2650
SP - 1
EP - 21
PB - Springer
AN - OPUS4-62574
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Resch-Genger, Ute
T1 - Career Options in Public Service
N2 - In the following, an overview of possible career options for chemists is presented covering metrology institutes, departmental research institutes of ministries, Federal and state research institutes and options in areas such as Federal or state institutions in charge of occupational safety, the German armed forces, wastewater treatment plants and labs/institutes controlling water quality, and museums. Thereby also examples and personal insights of the daily work routine are provided for some employers.
T2 - Career-Workshop ChiÖD
CY - Karlsruhe, Germany
DA - 02.04.2025
KW - Quality assurance
KW - Reference analysis
KW - Standardization
KW - Metrology
KW - Reference products
KW - Reference materials
KW - Mission
PY - 2025
AN - OPUS4-62867
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Resch-Genger, Ute
T1 - From molecular and nanoscale chromophores with UV/VIS/NIR/SWIR luminescence to multi method characterization of surface coatings
N2 - An overview of the research activities of division Biophotonics is presented covering examples for photophysical studies of different types of molecular and nanocrystalline luminophores, luminescent particles, and sensor systems in solution, in dispersion, and in the solid state and multi-method charactreization workflow for the characterization of surface-functionalized engineered nanomaterials. In addition, the importance of reliable optical measurements, particularly standardized workflows for the determination of the key performance parameter luminescence quantum yield of transparent and scattering luminescent samples with fluorescence and integrating sphere spectroscopy, and validated methods for quantifying surface functional groups and ligands on nanomaterials is highlighted. Thereby, also ongoing standardization activities are presented as well as certified reference materials and reference materials from division Biophotonics.
T2 - Chinese-German Chemical Association - Annual Meeting
CY - Berlin, Germany
DA - 22.08.2025
KW - Quality assurance
KW - Fluorescence
KW - Nano
KW - Particle
KW - Synthesis
KW - Quantum yield
KW - Characterization
KW - Advanced material
KW - Surface
KW - Lifetime
KW - Sensor
KW - Oxygen
KW - Ph
KW - Standardization
KW - Fluorescent probe
KW - Reference material
PY - 2025
AN - OPUS4-64181
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Tavernaro, Isabella
A1 - Sander, P. C.
A1 - Andresen, Elina
A1 - Schedler, U.
A1 - Resch-Genger, Ute
T1 - Expanding the Toolbox of Simple, Cost-Efficient, and Automatable Methods for Quantifying Surface Functional Groups on Nanoparticles� Potentiometric Titration
N2 - Measuring surface functional groups (FGs) on nanomaterials (NMs) is essential for designing dispersible and stable NMs with tailored and predictable functionality. FG screening and quantification also plays a critical role for subsequent processing steps, NM long-term stability, quality control of NM production, and risk assessment studies and enables the implementation of sustainable and safe(r)-by-design concepts. This calls for simple and cost-efficient methods for broadly utilized FGs that can be ideally automated to speed up FG screening, monitoring, and quantification. To expand our NM surface analysis toolbox, focusing on simple methods and broadly available, cost-efficient instrumentation, we explored a NM-adapted pH titration method with potentiometric and optical readout for measuring the total number of (de)protonable FGs on representatively chosen commercial and custom-made aminated silica nanoparticles (SiO2 NPs). The accuracy and robustness of our stepwise optimized workflows was assessed by several operators in two laboratories and method validation was done by cross-comparison with two analytical methods relying on different signal generation principles. This included traceable, chemo-selective quantitative nuclear magnetic resonance spectroscopy (qNMR) and thermogravimetric analysis (TGA), providing the amounts of amino silanes released by particle dissolution and the total mass of the surface coatings. A comparison of the potentiometric titration results with the reporter-specific amounts of surface amino FGs determined with the previously automated fluorescamine (Fluram) assay highlights the importance of determining both quantities for surface-functionalized NMs. In the future, combined NM surface analysis with optical assays and pH titration will simplify quality control of NM production processes and stability studies and can yield large data sets for NM grouping that facilitates further developments in regulation and standardization.
KW - Quality assurance
KW - Fluorescence
KW - Nano
KW - Particle
KW - Synthesis
KW - Characterization
KW - Advanced material
KW - Surface
KW - Standardization
KW - Reference material
KW - Functional group
KW - Quantification
KW - Coating
KW - Automation
KW - Potentiometry
KW - Method
KW - Validation
KW - Optical assay
KW - Fluram
KW - Fluorescamine
KW - qNMR
KW - Comparison
KW - ILC
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-642371
DO - https://doi.org/10.1021/acsmeasuresciau.5c00062
SN - 2694-250X
SP - 1
EP - 13
PB - American Chemical Society
CY - Washington, DC
AN - OPUS4-64237
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Stiegler, L. M. S.
A1 - Wegner, Karl David
A1 - Weigert, Florian
A1 - Peukert, W.
A1 - Resch-Genger, Ute
A1 - Walter, J.
T1 - Analysis of Giant-Shell CdSe/CdS Quantum Dots via Analytical Ultracentrifugation Combined with Spectrally Resolved Photoluminescence
N2 - Knowledge of the structure–property relationships of functional nanomaterials, including, for example, their size- and composition-dependent photoluminescence (PL) and particle-to-particle variations, is crucial for their design and reproducibility. Herein, the Angstrom-resolution capability of an analytical ultracentrifuge combined with an in-line multiwavelength emission detection system (MWE-AUC) for measuring the sedimentation coefficient-resolved spectrally corrected PL spectra of dispersed nanoparticles is demonstrated. The capabilities of this technique are shown for giant-shell CdSe/CdS quantum dots (g-QDs) with a PL quantum yield (PL QY) close to unity capped with oleic acid and oleylamine ligands. The MWE-AUC PL measurements are calibrated and validated with certified fluorescence standards. The spectrally corrected and size-dependent PL spectra of the g-QDs derived from a single MWE-AUC experiment are then analyzed and compared with the results of single-particle spectroscopic studies, yielding the PL spectra, decay kinetics, and blinking behavior of individual g-QDs. This study underlines the vast potential of MWE-AUC with in-line optical detection for the characterization of advanced nanomaterials with a complex structure.
KW - Quantum dots
KW - Analytical ultracentrifugation
KW - Photoluminescence
KW - Advanced nanomaterial characterization
KW - Calibrated fluorescence measurements
KW - Reference materials
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-624357
DO - https://doi.org/10.1002/smtd.202401700
SN - 2366-9608
SP - 1
EP - 7
PB - Wiley VHC-Verlag
AN - OPUS4-62435
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Richter, Maria
A1 - Güttler, Arne
A1 - Pauli, Jutta
A1 - Vogel, K.
A1 - Homann, Christian
A1 - Würth, Christian
A1 - Resch-Genger, Ute
T1 - Extending certified spectral fluorescence standards for the calibration and performance validation of fluorescence instruments to the NIR—closing the gap from 750 to 940 nm with two novel NIR dyes
N2 - Fluorescence techniques such as fluorescence spectroscopy, microfluorometry, and fluorescence microscopy, providing spectral, intensity, polarization, and lifetime information, are amongst the most broadly utilized analytical methods in the life and materials sciences. However, the measured fluorescence data contain sample- and instrument-specific contributions, which hamper their comparability across instruments and laboratories. Comparable, instrument-independent fluorescence data require the determination of the fluorescence instrument’s wavelength-dependent spectral responsivity, also termed emission correction curve, for the same instrument settings as those used for the fluorescence measurements as a prerequisite for the subsequent correction of the measured instrument-specific data. Such a spectral correction is essential for the performance comparison of different fluorescent labels and reporters, quantitative fluorescence measurements, the determination of the fluorescence quantum yield, and the spectroscopic measure for the fluorescence efficiency of a fluorophore. Simple-to-use tools for obtaining emission correction curves are chromophore-based reference materials (RMs), referred to as fluorescence standards, with precisely known, preferably certified instrument-independent fluorescence spectra. However, for the increasingly used near-infrared (NIR) wavelength region >700 nm, at present, no spectral fluorescence standards are available. To close this gap, we developed two novel spectral fluorescence standards, BAM F007 and BAM-F009, with broad emission bands from about 580 to 940 nm in ethanolic solution. These liquid fluorescence standards currently under certification, which will be released in 2025, will expand the wavelength range of the already available certified Calibration Kit BAM F001b-F005b from about 300–730 to 940 nm. In this research article, we will detail the criteria utilized for dye and matrix selection and the homogeneity and stability tests accompanying dye certification as well as the calculation of the wavelength-dependent uncertainty budgets of the emission spectra BAM F007 and BAM-F009, determined with the traceably calibrated BAM reference spectrofluorometer. These fluorescence standards can provide the basis for comparable fluorescence measurements in the ultraviolet, visible, and NIR for the fluorescence community.
KW - Quality assurance
KW - Reference material
KW - Fluorescence
KW - Dye
KW - Traceability
KW - Metrology
KW - Calibration
KW - Reference data
KW - Reference product
KW - Digital certificate
KW - NIR
KW - Instrument performance validation
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-626317
DO - https://doi.org/10.1007/s00216-024-05723-w
SN - 1618-2650
SP - 1
EP - 15
PB - Springer
AN - OPUS4-62631
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Resch-Genger, Ute
T1 - Molecular and nanoscale emitters photophysics , photoluminescence quantum yields, and surface chemistry
N2 - Inorganic nanocrystals such as spectrally shifting lanthanide-based nanoparticles (LnNCs) like NaYF4: Yb, Er and semiconductor quantum dots, organic and inorganic particles stained with sensor molecules, and organic dyes showing aggregation-induced emission are meanwhile broadly applied in the life and material sciences. The identification of optimum particle architectures and molecular structures for photonic applications requires quantitative spectroscopic studies and methods to control and analyse particle surface chemistry. In the following, photoluminescence studies of different emitter classes are presented, thereby addressing the measurement of particle brightness and photoluminescence quantum yields in different spectral windows parameters required for an in-depth mechanistic understanding. In addition, examples for the quantification of surface functional groups on nanomaterials with optical spectroscopy are given.
T2 - GdCH Kolloquium
CY - Düsseldorf, Germany
DA - 11.11.2025
KW - Dye
KW - Fluorescence
KW - Quantum yield
KW - Lifetime
KW - Sensor materials
KW - Temperature
KW - Cr(III) complex
KW - Nano
KW - Particle
KW - Silica
KW - Polymer
KW - Metrology
KW - Quality assurance
KW - Reference material
KW - Surface chemistry
KW - Size
KW - Shape
KW - Particle number concentration
KW - Method
KW - Optical assay
KW - qNMR
KW - Validation
KW - Potentiometry
KW - XPS
PY - 2025
AN - OPUS4-64728
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Tavernaro, Isabella
A1 - Sander, P.
A1 - Andresen, Elina
A1 - Schedler, U.
A1 - Resch-Genger, Ute
T1 - Potentiometric and Optical Titration for Cost- Efficient Quantification of Surface Functional Groups on Silica Nanoparticles
N2 - Surface chemistry of engineered nanomaterials (NMs) plays a critical role not only in determining their interactions with the environment but also in their stability, safety, and functionality across diverse applications ranging from catalysis to biomedicine. Accurate quantification of surface functional groups (FGs) is therefore essential for quality control, risk assessment, and performance optimization.[1] However, many existing analytical techniques are either cost-intensive, require specialized instrumentation, or lack scalability for routine use.
In this study, we present a comparative evaluation of potentiometric and optical titration as two simple, cost-efficient, and automatable methods for quantifying surface functional groups on a variety of surface-modified silica nanoparticles (SiO₂ NPs). These NPs were chosen as they are among the most frequently utilized engineered NMs in the life and material sciences.
Potentiometric titration, based on pH monitoring during acid-base neutralization, offers a direct and label-free approach to determine the total amount of FGs. Optical titration provides a complementary method with potential for high-throughput screening. To examine the accuracy and robustness of our stepwise-optimized workflows and the achievable relative standard deviations (RSDs), measurements were performed by multiple operators in two laboratories. Method validation was conducted through cross-comparison with traceable, chemo-selective quantitative nuclear magnetic resonance spectroscopy (qNMR) and thermogravimetric analysis (TGA). A comparison with optical assays highlights the importance of measuring both quantities for comprehensive characterization of surface-modified NMs.[2]
A combined NM surface analysis using optical assays and pH titration will simplify quality control of NM production processes and stability studies, and can yield large datasets for NM grouping in sustainable and safe(r)-by-design studies.
T2 - eMRS Fall Meeting 2025
CY - Warsaw, Poland
DA - 15.09.2025
KW - Fluorescence
KW - Advanced material
KW - Synthesis
KW - Characterization
KW - Nano
KW - Particle
KW - Silica
KW - Surface analysis
KW - Validation
KW - qNMR
KW - Fluram assay
KW - Functional group
KW - Quantification
KW - Potentiometry
KW - Amino groups
KW - Fluorescamine
KW - Calibration
KW - Method comparison
PY - 2025
AN - OPUS4-64205
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Resch-Genger, Ute
T1 - Quantifying functional groups and coatings on nanoobjects
N2 - Engineered nanomaterials (NM) of different size, shape, chemical composition, and surface chemistry are increasingly used for many key technologies of the 21st century and consumer products. This includes polymer and silica or silica-coated nanoparticles (NP) with covalently bound surface groups, semiconductor quantum dots (QD), metal and metal oxide NP, and lanthanide NP with coordinatively or electrostatically bound ligands, as well as surface-coated nanostructures like micellar encapsulated NP. Decisive for most applications of NMs are their specific surface properties, which are largely determined by the chemical nature and amounts of ligands and functional groups (FGs) on the NM surface. The surface chemistry can strongly affect the physicochemical properties of NM, their charge, hydrophilicity/hydrophobicity, reactivity, function, stability, and processability and thereby their impact on human health and environment. Knowledge of NM surface chemistry plays an important role for NM functionality and performance in (bio)applications and the fate, exposure, dissolution, transformation, and accumulation of NM, and thus, the potential risks for human health and the environment. This highlights the importance of reliable, validated, and eventually standardized analytical methods for analyzing and quantifying NM surface chemistry for process and quality control of NM production, safe use of NMs, design of novel NM, and sustainable concepts for NM fabrication.[1-3] In this context, interlaboratory comparisons (ILCs) are needed to assess method reliability and reference materials with known surface chemistries for establishing surface analytical methods and their performance validation.[2,4] Also, to respond to the increasing number of samples to be analyzed, cost-efficient automation concepts for surface analysis are needed that can be realized with affordable and preferably commercial instrumentation.[5] Here, we provide an overview of analytical methods for FG analysis and quantification used by us for quantifying broadly utilized FGs and ligands on different types of NMs with electrochemical titration methods, optical assays, nuclear magnetic resonance (NMR) and vibrational (IR) spectroscopy, and X-ray based and thermal analysis methods.[1,2] Thereby, method- and material-related challenges are addressed, and the importance of multi-method characterization approaches easing method validation by method cross-validation. Special emphasis is dedicated to simple, versatile, and cost-efficient methods such as optical assays and electrochemical titration methods.
T2 - eMRS Fall Meeting 2025
CY - Warsaw, Poland
DA - 15.09.2025
KW - Quality assurance
KW - Fluorescence
KW - Nano
KW - Particle
KW - Synthesis
KW - Characterization
KW - Advanced material
KW - Surface
KW - Standardization
KW - Reference material
KW - Functional group
KW - Quantification
KW - Coating
KW - Interlaboratory comparison
KW - Uncertainty
PY - 2025
AN - OPUS4-64183
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Resch-Genger, Ute
T1 - Assessing different types of silica networks for the complete protection of nir luminescent molecular rubies from oxygen quenching in air
N2 - The application of emerging luminophores such as near-infrared (NIR) emissive earth-abundant chromium(III) (CrIII) complexes and triplet-triplet annihilation upconversion (TTA-UC) systems in air as optical reporters for bioimaging or photonic materials for energy conversion requires simple and efficient strategies for their complete protection from luminescence quenching by oxygen. Therefore, we explored the influence of sol-gel synthesis routes on the oxygen protection efficiency of the resulting core and core/shell silica nanoparticles (SiO2 NPs), utilizing the molecular ruby-type luminophores CrPF6 ([Cr(ddpd)2](PF6)3; ddpd = N,N’-dimethyl- N,N’-dipyridin-2-ylpyridin-2,6-diamine) and CrBF4 ([Cr(ddpd)2](BF4)3) with their oxygen-dependent, but polarity-, proticity-, viscosity-, and concentration-independent luminescence as optical probes for oxygen permeability. The sol-gel chemistry routes we assessed include the classical Stöber method and the underexplored larginine approach, which relies on the controlled hydrolysis of tetraethoxysilane (TEOS) in a biphasic cyclohexane/water system with the catalyst l-arginine. As demonstrated by luminescence measurements of air- and argon-saturated dispersions of CrPF6- and CrBF4-stained SiO2 NPs of different size and particle architecture, utilizing the luminescence decay kinetics of argon-saturated solutions of CrPF6 and CrBF4 in acetonitrile (ACN) as benchmarks, only SiO2 NPs or shells synthesized by the l-arginine approach provided complete oxygen protection of the CrIII complexes under ambient conditions. We ascribe the different oxygen shielding efficiencies of the silica networks explored to differences in density and surface chemistry of the resulting nanomaterials and coatings, leading to different oxygen permeabilities. Our l-arginine based silica encapsulation strategy can open the door for the efficient usage of oxygen-sensitive luminophores and TTA-UC systems as optical reporters and spectral shifters in air in the future.
T2 - eMRS Strasbourg
CY - Strasbourg, France
DA - 26.05.2025
KW - Quality assurance
KW - Fluorescence
KW - Nano
KW - Particle
KW - Synthesis
KW - Quantum yield
KW - NIR
KW - Mechanism
KW - Characterization
KW - Electron microscopy
KW - Silica
KW - Oxygen sensing
KW - Surface
KW - Doping
KW - Lifetime
KW - Cr(III) complex
PY - 2025
AN - OPUS4-63300
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Frenzel, F.
A1 - Fiedler, S.
A1 - Bardan, A.
A1 - Güttler, Arne
A1 - Würth, Christian
A1 - Resch-Genger, Ute
T1 - Influence of Measurement Geometry and Blank on Absolute Measurements of Photoluminescence Quantum Yields of Scattering Luminescent Films
N2 - For a series of 500 μm-thick polyurethane films containing different concentrations of luminescent and scattering YAG:Ce microparticles, we systematically explored and quantified pitfalls of absolute measurements of photoluminescence quantum yields (Φf) for often employed integrating sphere (IS) geometries, where the sample is placed either on a sample holder at the bottom of the IS surface or mounted in the IS center. Thereby, the influence of detection and illumination geometry and sample position was examined using blanks with various scattering properties for measuring the number of photons absorbed by the sample. Our results reveal that (i) setup configurations where the scattering sample is mounted in the IS center and (ii) transparent blanks can introduce systematic errors in absolute Φf measurements.
For strongly scattering, luminescent samples, this can result in either an under- or overestimation of the absorbed photon flux and hence an under- or overestimation of Φf. The size of these uncertainties depends on the scattering properties of the sample and instrument parameters, such as sample position, IS size, wavelength-dependent reflectivity of the IS surface coating, and port configuration. For accurate and reliable absolute Φf measurements, we recommend (i) a blank with scattering properties closely matching those of the sample to realize similar distributions of the diffusely scattered excitation photons within the IS, and (ii) a sufficiently high sample absorption at the excitation wavelength. For IS setups with center-mounted samples, measurement geometries should be utilized that prevent the loss of excitation photons by reflections from the sample out of the IS.
KW - Quality assurance
KW - Fluorescence
KW - Nano
KW - Particle
KW - Quantum yield
KW - Characterization
KW - Silica
KW - Scattering
KW - Uncertainty
KW - Film
KW - Pphosphor
KW - YAG:Ce
KW - LED
KW - Converter material
KW - Solid material
KW - Polymer
KW - Composite material
KW - Advanced material
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-638304
DO - https://doi.org/10.1021/acs.analchem.4c06726
SN - 1520-6882
SP - 1
EP - 8
PB - ACS Publications
AN - OPUS4-63830
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Güttler, Arne
T1 - Certified Reference Materials for the Quantification and Standardization of Fluorescence-based Measurements
N2 - The size and shape of photoluminescence signals is affected by wavelength-, polarization-, and time-dependent instrumentspecific contributions and the compound- and environment-specific photoluminescence quantum yield. The former hamper the comparability of fluorescence measurements performed on different measuring devices. The commonly relatively done determination of the performance parameter requires suitable quantum yield standards with well-known. The performance of such measurements is, e.g., described in the written standard IEC 62607 currently revised.
T2 - Colloquium für Optische Spektrometrie 2025
CY - Jena, Germany
DA - 24.09.2025
KW - Quality assurance
KW - Fluorescence
KW - Nano
KW - Particle
KW - Advanced material
KW - Calibration
KW - Characterization
KW - Fluorescence quantum yield
KW - Phosphor
KW - Absolute
KW - Integrating sphere spectroscopy
KW - Dye
KW - Standardization
KW - Reference material
KW - Interlaboratory comparison
KW - Uncertainty
PY - 2025
AN - OPUS4-64213
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Oskoei, Parastu
T1 - Thermoresponsive UCNP@MSN Nanoparticles for Doxorubicin Delivery in Melanoma Cells
N2 - Upconversion nanoparticles (UCNPs) possess unique photophysical characteristics, such as excita bility by near infrared (NIR) light, which facilitates deep tissue penetration, multi color emission , long luminescence lifetimes, and an excellent photostability. These features have made UCNPs promising tools for biomedical applications . M esoporous silica nanoparticles (MSNs) functionalized with stimuli responsive nanovalves or specific coatings enable the encapsulation and controlled release of therapeutic agen ts, thereby offering spatiotemporal precision in drug delivery 1 3 ]]. Among drug delivery strategies, photoresponsive systems have attracted growing attention due to their potential for clinical applications . This is especially relevant for melanoma, an aggressive skin cancer with increasing global incidence, for which conventional therapeutic modalities remain largely insufficient in advanced stage 4 In this work, core shell UCNP@MSN nanoparticles were synthetised by coating UCNPs with a mesoporous silica layer, which was subsequently functionalized with thermoresponsive retro Diels Alder nanovalves [ and loaded with the chemotherapeutic agent doxorubicin (DOX). Controlled drug release was effectively achieved under 980 nm NIR i llumination . Treatment with functionalized nanoparticles significantly reduced the viability of melanoma cell lines, with an enhanced cytotoxicity being observed upon combined nanoparticle exposure and NIR illumination . Mechanistic analyses revealed that neither UCNPs nor NIR i llumination alone could induce the production of reactive oxygen species (ROS); however, their combination induced a marked increase in ROS levels in two of the three tested cell lines. Furthermore, this dual treatment promoted substantial apoptotic and/or necrotic responses across all cell models. These findings underscore the potential of UCNP@MSN nanoplatforms, equipped with thermoresponsive ga tes , as efficient photoactivated drug delivery systems for melanoma therapy.
T2 - Conference Jornadas CICECO
CY - Aveiro, Portugal
DA - 09.10.2025
KW - Nano
KW - Particle
KW - Lanthanide
KW - Upconversion
KW - Surface chemistry
KW - Mesoporous silica
KW - Doxorubicin
KW - Nanomedicine
KW - Triggered release
KW - pH
KW - Cellular uptake
KW - Toxicity
KW - Folate
KW - Ligand
PY - 2025
AN - OPUS4-64371
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Resch-Genger, Ute
T1 - Quantifying the total and accessible amount of surface functionalities and ligands on nanomaterials
N2 - Engineered nanomaterials (NMs) of various chemical composition and surface functionalization are routinely fabricated for industrial applications such as medical diagnostics, drug delivery, sensing, catalysis, energy conversion and storage, opto-electronics, and information storage. NM dispersibility, stability, processability, and function as well as the interaction with biological species and environmental fate are largely determined by NM surface functionalities, i.e., functional groups (FGs) and ligands. Therefore, reliable, reproducible, and eventually standardized surface characterization methods are vital for quality control of NMs, and mandatory to meet increasing concerns regarding their safety.
Suitable methods for determining surface functionalities on ligand-stabilized core and core/shell NPs include advanced techniques such as traceable quantitative nuclear magnetic resonance (qNMR) as well as X-ray electron spectroscopy (XPS) and time of flight secondary ion mass spectrometry (ToF-SIMS), and simpler optical and electrochemical methods.[1] The latter less costly and fast methods, which can be automated, are often used by NM producers for process and quality control.[1,2] To validate methods, establish measurement uncertain-ties, test reference materials, and produce reference data, multi-method characterization studies are needed.[3,4] as well as interlaboratory comparisons (ILC) on determining NM surface chemistry and well characterized test and reference NMs providing benchmark values.[5,6] Here, we present examples for quantifying common surface FGs such as amino and carboxyl groups on functional NMs of different chemical composition such as silica, polymer, iron oxide, and lanthanide-based upconversion nanoparticles with optical assays, electrochemical titration methods, qNMR, and chromatographic separation techniques. In addition, ongoing interlaboratory comparisons will be presented.
T2 - Yucomat 2025
CY - Herec Novi, Montenegro
DA - 01.09.2025
KW - Quality assurance
KW - Fluorescence
KW - Nano
KW - Particle
KW - Synthesis
KW - Characterization
KW - Advanced material
KW - Surface
KW - Standardization
KW - Reference material
KW - Functional group
KW - Quantification
KW - Coating
KW - Interlaboratory comparison
KW - Uncertainty
PY - 2025
AN - OPUS4-64182
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Resch-Genger, Ute
T1 - Measurements of Photoluminescence Quantum Yields of Scattering LED Converter Materials
N2 - How to Get it Right with the Absolute Measurement of Photoluminescence Quantum Yields of Scattering LED Converter Materials Saskia Fiedler+,a, Florian Frenzel+,a, Christian Würth a, Isabella Tavernaro a, Michelle Grüne c, Stefan Schweizer c,d, Axel Engel e, and Ute Resch-Genger a* a Division Biophotonics, Federal Institute for Materials Research and Testing (BAM), Richard-Willstaetter-Strasse 11, D-12489 Berlin, Germany; email: ute.resch@bam.de b Present address: Photonic Materials, NWO-Institute AMOLF, Science Park 104, 1098 XG Amsterdam, The Netherlands c Faculty of Electrical Engineering, South Westphalia University of Applied Sciences, Lübecker Ring 2, 59494, Soest, Germany d Fraunhofer Application Center for Inorganic Phosphors, Branch Lab of Fraunhofer Institute for Microstructure of Materials and Systems IMWS, Lübecker Ring 2, 59494, Soest, Germany e Schott AG Technical Services, Hattenbergstrasse 10, D-55122 Mainz, Germany Optical measurements of scattering materials such as luminescent nano- and microparticles and phosphors dispersed in liquid and solid matrices play an important role in energy conversion, solid-state lighting, medical diagnostics, and security barcoding. A key performance parameter is the photoluminescence quantum yield QY, i.e., the number of emitted per number of absorbed photons. QY of transparent luminophore solutions can be obtained relative to a fluorescence QY standard of known QY, meanwhile available as certified reference materials.[1] The determination of QY of scattering liquid and solid samples like nanoparticle dispersions, phosphors, and optoceramics requires, however, absolute measurements with an integrating sphere setup. Despite the need for reliable absolute QY measurements, no interlaboratory comparison (ILCs) on measurement uncertainties has been performed and scattering standards with known QY are not available. We present the results of an ILC of 3 labs from academia and industry on measurements of transparent and scattering dye solutions and solid phosphors and converter materials like YAG:Ce optoceramics with commercial stand-alone integrating sphere setups of different illumination and detection geometries. Special emphasis was dedicated to the influence of measurement geometry, optical properties of the blank for determining the number of incident photons absorbed by the sample, and sample-specific surface roughness. Matching QY values could be obtained for transparent dye solutions and scattering dispersions with a blank with scattering properties closely matching those of the sample, QY measurements of optoceramic samples with different blanks revealed substantial differences of more than 20 %. Based on our data, we recommend non-absorbing blank materials with a high reflectivity (>95 %) such as a 2 mm-thick PTFE target placed on the sample holder as blanks.
T2 - eMRS
CY - Strasbourg, France
DA - 26.05.2025
KW - Quality assurance
KW - Fluorescence
KW - Nano
KW - Particle
KW - Quantum yield
KW - NIR
KW - Characterization
KW - Electron microscopy
KW - Film
KW - Integrating sphere spectroscopy
KW - Calibration
KW - Lifetime
KW - Advanced materials
KW - LED converter
KW - YAG:Ce
KW - ILC
KW - Measurement uncertainty
KW - Absolute quantum yield
PY - 2025
AN - OPUS4-63327
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Rezvani, A.
A1 - Wang, Z.
A1 - Wegner, Karl David
A1 - Soltanmoradi, H.
A1 - Kichigin, A.
A1 - Zhou, X.
A1 - Gantenberg, T.
A1 - Schram, J.
A1 - Zubiri, B. A.
A1 - Spiecker, E.
A1 - Walter, J.
A1 - Resch-Genger, Ute
A1 - Segets, D.
T1 - Separation of Indium Phosphide/Zinc Sulfide Core−Shell Quantum Dots from Shelling Byproducts through Multistep Agglomeration
N2 - Semiconductor quantum dots (QDs) possess unique electronic and optical properties, making them promising candidates for applications in lightemitting diodes, solar cells, bioimaging, and photocatalysis. Precise control over their size, shape, and chemical and electronic structure is crucial to ensure the desired functional properties and optimize device performance. However, challenges in QD synthesis and post-synthesis modification persist, especially in large-scale production. This study addresses the classification of QDs synthesized in a tubular flow reactor consisting of a mixture of the desired InP/ZnS core−shell QDs and QDs made from the shell material, i.e., here ZnS QDs formed as a byproduct during the formation step of the ZnS shell. The homogeneous nucleation of ZnS nanoparticles from the shelling material introduces a heterogeneity in size and composition and affects the optical properties of the resulting QDs. To address this issue, we developed a size-selective agglomeration (SSA) technique by incrementally introducing ethanol as a poor solvent and classified the synthesized QDs into 13 distinct fractions. These 13 fractions are sorted into three distinct groups: (i) larger InP/ZnS QDs, (ii) a combination of smaller InP/ZnS QDs and larger ZnS QDs, and (iii) predominant ZnS QDs with some very tiny InP/ZnS QDs. The comprehensive characterization of the fractions was conducted using UV−visible absorption spectroscopy, photoluminescence spectroscopy, high-resolution scanning transmission electron microscopy, energy-dispersive X-ray spectroscopy, total reflection X-ray fluorescence, and analytical ultracentrifugation. We could demonstrate that our method effectively separated unwanted ZnS QDs from the target InP/ZnS QDs. In addition, the fractions enriched in smaller InP/ZnS QDs exhibited a higher photoluminescence quantum yield compared to the fractions with larger QDs. This demonstrates the efficacy of SSA in finetuning the composition of QD mixtures produced on a larger scale to improve their functional properties. This approach provides fundamental understanding toward the development of a scalable two-dimensional classification process for such ultrasmall nanoparticles by particle size and composition.
KW - Quality assurance
KW - Reference material
KW - Nano
KW - Particle
KW - Quantum dot
KW - Synthesis
KW - Flow reactor
KW - InP
KW - Shell
KW - ZnS
KW - Surface chemistry
KW - Method
KW - Fluorescence
KW - Quantum yield
KW - TEM
PY - 2025
DO - https://doi.org/10.1021/acsnano.4c18530
SN - 1936-086X
VL - 19
IS - 20
SP - 19080
EP - 19094
PB - ACS Publications
AN - OPUS4-63215
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Oskoei, Párástu
T1 - Cell mechanisms induced by doxorubicin-loaded UCNP@MSN nanoparticles with a thermosresponsive nanovalve in melanoma cells
N2 - Upconversion nanoparticles (UCNPs) exhibit several remarkable optical properties, including excitation by near infrared (NIR) light, which enables deep tissue penetration, multiple distinct emission bands across a wide range of wavelengths, long luminescen ce lifetimes, and high photostability. These features make them particularly attractive for various biomedical applications. Mesoporous silica nanoparticles (MSNs), functionalized with nanovalves or specific coatings, have been explored for controlled and targeted drug delivery, where therapeutic agents are encapsulated within the nanopores, allowing spatiotemporal release 1 3 ]]. Among the promising approaches, photoactivated drug delivery systems have drawn considerable interest due to their versatility and potential. One relevant application is in the treatment of melanoma, an aggressive form of skin cancer with a rising global incidence. In advanced stages, conventional therapies often fail to achieve complete tumour eradication, resulting in poor prognose s 4 In this study, UCNPs were coated with a mesoporous silica shell to form core shell UCNP@MSN nanoparticles, which were further functionalized with thermoresponsive retro Diels Alder nanovalves and loaded with doxorubicin (DOX), a chemotherapeutic drug used in melanoma treatment. Upon exposure to 980 nm NIR light, DOX release was successfully triggered in the culture medium. Exposure to functionalized UCNPs decreased the viability of the tested melanoma cell lines, with further reductions observed when the ex posure to the nanoparticles was combined with irradiation. Subsequently, t he toxicity mechanisms were evaluated and showed that w hile individual treatments with either the functionalized UCNPs or NIR irradiation alone had no effect on reactive oxygen species (ROS) production, their combination significantly increased ROS levels in two of the three tested cell lines. This combined treatment also led to notable increases in apoptotic , necrotic or both type of cells’ percentages on all cell lines. Overall, these findings highlight the potential of these nanoparticles with thermoresponsive gating mechanisms as effective platforms for targeted drug delivery in melanoma therapy.
T2 - EUROTOX 2025
CY - Athens, Greece
DA - 14.09.2025
KW - Nano
KW - Particle
KW - Lanthanide
KW - Upconversion
KW - Surface chemistry
KW - Mesoporous silica
KW - Doxorubicin
KW - Nanomedicine
KW - Triggered release
KW - pH
KW - Cellular uptake
KW - Toxicity
KW - Folate
KW - Ligand
PY - 2025
AN - OPUS4-64372
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Tavernaro, Isabella
A1 - Simon, Fabian
A1 - Gehrenkemper, Lennart
A1 - Tobias, Charlie
A1 - Resch-Genger, Ute
A1 - Meermann, Björn
T1 - Quantification of the amount of surface groups of aminated silica nano- and microparticles utilizing a fluorine tag and HR-CS-GFMAS
N2 - The performance, bioavailability, and safe use of engineered nanomaterials (NMs) depends not only on properties such as size, shape, and surface area, but largely on surface chemistry. While many sizing methods have been established, there is still a lack of validated screening methods for determining NM surface functional groups (FGs). In this context, we present a fast and simple method for FG quantification using high resolution-continuum source-graphite furnace molecular absorption spectrometry (HR-CS-GFMAS) and assess its applicability for the surface analysis of representatively chosen aminated silica nanoparticles (NPs) and microparticles (MPs) in conjunction with amino FG labeling with a fluorine tag. For this proof-of-concept study, first surface amino FG screening of the silica NPs and MPs was done with a potentiometric back titration method, providing the total amount of protonatable surface FGs, and two optical assays relying on reporter dyes with sizes and spatial requirements, i.e., surface binding areas smaller or larger than that of the fluorine tag to estimate the maximum and reporter-accessible number of amino FGs. Subsequently, the surface amino FGs were labeled with the fluorine tag 4-(trifluoromethyl)benzoic acid (TFMB) and the amount of fluorine originating from the bound TFMB molecules was quantified by HR-CS-GFMAS in two common organic solvents, i.e., dimethyl sulfoxide (DMSO) or ethanol (EtOH) to assess possible interferences from organic matrices. Our study revealed limits of detection (LODs) and quantification (LOQs) for fluorine of 1.0 µg/L and 3.5 µg/L in EtOH and 1.5 µg/L and 5.0 µg/L in DMSO, respectively. Overall, a quick and simple method for analyzing surface FGs on NPs and MPs was presented utilizing broadly available fluorine tags and HR-CS-GFMAS for fluorine quantification, which can be applied, e.g., for homogeneity, stability, and aging studies of surface-modified particles. This could contribute to ease the understanding of property-safety relationships for surface-functionalized NMs.
KW - Fluorine Analysis
KW - Nano- and microparticles
KW - Surface group quantification
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-641965
DO - https://doi.org/10.1007/s00216-025-06107-4
SN - 1618-2642
SP - 1
EP - 11
PB - Springer Science and Business Media LLC
CY - Berlin ; Heidelberg
AN - OPUS4-64196
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Oskoei, Párástu
T1 - Effects of upconversion nanoparticles with a thermo-responsive nanovalve loaded with doxorubicin in melanoma cells
N2 - Melanoma skin cancer has an increasingly higher incidence , and w hen detected in advanced stages, tumour eradication is often incomplete, contributing to poor prognosis with conventional treatments. Upconversion nanoparticles (UCNPs) have unique properties, such as excitability under near infrared (NIR) excitation light, which confers a relatively high penetration depth in tissue that allow their effective use in several biomedical applications Mesoporous silica nanoparticles (MSN) with nanovalves or derived coatings have widely been used for triggered and targeted drug delivery in the past. Anticancer drugs can be loaded into the pores of MSN, enabling controlled drug release. In this work, UCNPs were coated with a mesoporous silica shell yielding UCNP@MSN core shell nanoparticles which were equipped with thermoresponsive retro Diels Alder nanovalves and then loaded with DOX , a chemotherapeutic agent for melanoma treatmen t (UCNP@MSN DOX) Subsequent DOX release from this drug delivery system was triggered by 980 nm NIR light. Melanoma cells exposed to UCNP@MSN DOX or the NIR laser exhibited no change in ROS production , while the combination of both induced an increase in ROS production. This combination of conditions also induced changes on apoptosis and necrosis levels. These findings underscore the potential use of UCNP @MSN drug delivery systems with thermoresponsive caps as effective drug delivery platforms for melanoma therapy.
T2 - VII iBiMED Symposium
CY - Aveiro, Portugal
DA - 23.05.2025
KW - Nano
KW - Particle
KW - Lanthanide
KW - Upconversion
KW - Surface chemistry
KW - Mesoporous silica
KW - Doxorubicin
KW - Nanomedicine
KW - Triggered release
KW - pH
KW - Cellular uptake
KW - Toxicity
KW - Folate
KW - Ligand
PY - 2025
AN - OPUS4-64373
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - GEN
A1 - Resch-Genger, Ute
A1 - Richter, Maria
A1 - Güttler, Arne
A1 - Pauli, Jutta
A1 - Vogel, K.
A1 - Homann, Christian
A1 - Würth, Christian
T1 - Extending Certified Spectral Fluorescence Standards for the Calibration and Performance Validation of Fluorescence Instruments to the NIR – Closing the Gap from 750 nm to 940 nm with Two Novel NIR Dyes
N2 - Fluorescence methods provide spectral, intensity, polarization, and lifetime information, which contain sample- and instrument-specific contributions. Fluorescence data, comparable across instruments and laboratories, require validated calibration procedures and certified fluorescence standards.
KW - Quality assurance
KW - Reference material
KW - Fluorescence
KW - Dye
KW - Traceability
KW - Metrology
KW - Calibration
KW - Reference data
KW - Reference product
KW - Digital certificate
KW - NIR
KW - Instrument performance validation
PY - 2025
SP - 1
EP - 4
PB - Springer Nature
CY - London
AN - OPUS4-62739
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Andreato, E.
A1 - Panov, N.
A1 - Artiga, A.
A1 - Osipova, Viktoriia
A1 - Resch-Genger, Ute
A1 - Ximendes, E.
A1 - Molina, P.
A1 - Canton, P.
A1 - Marin, R.
T1 - Indium-Based Fluoride Nanoparticles Doped with Chromium for Near-Infrared Luminescence
N2 - Transition metal (TM) and rare earth (RE) ion-doped nanoparticles (NPs) are photoluminescent materials of technological relevance in bioimaging, sensing, and light conversion. Fluoride NPs are particularly attractive in this context, since they combine low-energy phonons, high chemical stability, optical transparency, size, and architecture tunability. Yet, nearly all reported colloidal fluoride NPs (e.g., NaYF4 and LiYF4) can only be efficiently doped with RE3+ and not with luminescent TM ions. Herein, we contribute to filling this gap in materials science by reporting Na3InF6 NPs doped with Cr3+ as a model luminescent TM ion. We unveil the heat-driven NP formation mechanism, which involves a cubic-to-monoclinic phase conversion, similarly to the cubic-tohexagonal phase conversion in NaYF4. Reaction temperatures above 225 °C and reaction time have a limited impact on the NP morphology, while the amount of fluoride precursor and oleylamine grants control over the NP size. After verifying that Na3InF6 NPs show negligible cytotoxicity toward U-87 cell line, we study the optical properties of these NPs upon Cr3+ doping.
Temperature-dependent photoluminescence measurements indicate that Cr3+ ions experience a weak crystal field in the Na3InF6 host lattice, while their photoluminescence lifetime varies linearly in the 20−50 °C range. These results set the ground for further studies of photoluminescent TM-doped fluoride NPs, toward their applications in bioimaging, sensing, and light-converting devices.
KW - Quality assurance
KW - Fluorescence
KW - Traceability
KW - Nano
KW - Particle
KW - Synthesis
KW - Quantum yield
KW - NIR
KW - Mechanism
KW - Characterization
KW - XRD
KW - Phase transition
KW - Ligand
KW - Surface
KW - Doping
KW - Lifetime
PY - 2025
DO - https://doi.org/10.1021/acs.chemmater.4c03335
SN - 1520-5002
SP - 1
EP - 14
PB - American Chemical Society
AN - OPUS4-63073
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Matiushkina, Anna
T1 - Quantification of Citrate Ligands on Nanoparticle Surfaces
N2 - To ensure the successful advancement of nanomaterials (NM) in applications and their safe use, it is crucial to develop reliable methods to control and quantify ligands and functional groups (FG) on the nanoparticle (NP) surface as surface chemistry largely determines the interactions of NPs with their surroundings. Many analytical methods can be used for this purpose. However, their applicability strongly depends on the type of NM and ligand(s) and most of them require challenging protocols for sample preparation, i.e., the removal of the NPs or their dissolution, which can influence the accuracy of the measurements. While some methods allow the precise quantification of specific ligands such as quantitative nuclear magnetic resonance (qNMR), others provide only semi-quantitative results like Fourier Transform infrared spectroscopy (FTIR) or target more general analyte groups like thermogravimetric analysis (TGA) detecting mass losses (total organic content) or conductometry (e.g., (de)protonable FGs such as carboxyl or amine groups). [1] The calculation of the coverage of the NP surface with ligands, additionally requires knowledge of their total surface area, which can be obtained, e.g., from a precise characterization of NP size and concentration.
Citrate is one of the most frequently utilized surface ligand for stabilizing metal, metal oxide, and lanthanide-based upconversion NPs in hydrophilic environments. However, its quantification on NP surfaces has rarely been addressed although it is a frequent analyte in medical or food analysis. In this study we compare several methods for quantifying citrate as capping ligands of iron oxide NPs (IONPs), exemplarily chosen because of their broad applications in the life science. [2] The size of the IONPs was characterized by electron microscopy (EM) and dynamic light scattering (DLS), while their concentration was determined by quantifying iron ions after acidic particle dissolution using a colorimetric assay and inductively coupled plasma optical emission spectroscopy (ICP-OES). The simplest approach for citrate quantification, direct photometric UV-detection after acidic digestion of the IONPs, yielded only reasonable results when combined with reversed phase high-performance liquid chromatography (HPLC). These results were cross validated with qNMR that required the development of a reliable sample preparation protocol addressing not only particle dissolution in deuterated solvents but also the removal of the paramagnetic iron ions interfering with NMR measurements. Comparison with results from TGA gives insight into the sensitivity and specificity of these methods and their potential for quantifying surface ligands on NPs.
T2 - Anakon 2025
CY - Leipzig, Germany
DA - 10.03.2025
KW - Advanced material
KW - Functional group
KW - Iron oxide
KW - Ligand
KW - Nano
KW - Particle
KW - Quantification
KW - Surface analysis
PY - 2025
AN - OPUS4-64861
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Gawlitza, Kornelia
T1 - Using Dual Fluorescent Molecularly Imprinted Particles Coupled with a Miniaturized Opto-Microfluidic Platform for On-Site Detection of Perfluoroalkyl Carboxylic Acids
N2 - Per- and polyfluoroalkyl substances (PFAS) are a group of synthetic organofluorine chemicals widely used in the production of various materials, including firefighting foams, adhesives, and coatings that resist stains and oil. In recent years, PFAS have gained attention as emerging environmental contaminants, with particular emphasis on perfluoroalkyl carboxylic acids (PFCAs), the most common type of PFAS. PFCAs are defined by a fully fluorinated carbon chain and a charged carboxylic acid group. They have been classified as Substances of Very High Concern and included in the REACH Candidate List due to their persistence, resistance to biodegradation, and toxicological impacts.
Traditional methods for analyzing PFCAs, like GC-MS, HRMS, and HPLC-based techniques, are time-consuming, non-portable, expensive, and require specialized expertise. On the other hand, fluorescence assays offer a user-friendly, portable, and cost-effective alternative with high sensitivity and quick results, particularly when the binding of the analyte causes a specific increase in the probe’s fluorescence. Combining these probes with a carrier platform and a miniaturized optofluidic device presents a promising approach for PFCA monitoring.
In this study, a new guanidine BODIPY fluorescent indicator monomer was synthesized, characterized, and incorporated into a molecularly imprinted polymer (MIP) designed for the specific detection of perfluorooctanoic acid (PFOA). The MIP layer was formed on silica core nanoparticles doped with tris(bipyridine)ruthenium(II) chloride, serving as an optical internal reference for calibration-free assays. In combination with an extraction step prior to sample analysis, this system enables selective and reliable detection of PFCAs in surface water samples, minimizing interference from competing substances, matrix effects, and other factors. When integrated into an opto-microfluidic setup, the assay provided a compact, user-friendly detection system capable of detecting micromolar levels of PFOA in under 15 minutes from surface water samples.
T2 - ANAKON2025
CY - Leipzig, Germany
DA - 10.03.2025
KW - Perfluorooctanoic Acid (PFOA)
KW - On-site detection
KW - Fluorescence
KW - Microfluidics
KW - Molecularly Imprinted Polymers
PY - 2025
AN - OPUS4-62712
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Fayis Kalady, Mohammed
A1 - Schultz, Johannes
A1 - Weinel, Kristina
A1 - Wolf, Daniel
A1 - Lubk, Axel
T1 - Geometry-dependent localization of surface plasmons on random gold nanoparticle assemblies
N2 - Assemblies of plasmonic nanoparticles (NPs) support hybridized modes of localized surface plasmons (LSPs), which delocalize in geometrically well-ordered arrangements. Here, the hybridization behavior of LSPs in geometrically completely disordered two-dimensional arrangements of Au NPs fabricated by an e-beam synthesis method is studied. Employing electron energy loss spectroscopy in a scanning transmission electron microscope and numerical simulations, the disorder-driven spatial and spectral localization of the coupled LSP modes that depends on the NP thickness is revealed. Below a NP thickness of 0.4 nm, localization increases toward higher hybridized LSP mode energies. In comparison, above 10 nm thickness, a decrease of localization toward higher mode energies is observed. In the intermediate thickness regime, a transition of the energy dependence of the localization between the two limiting cases, exhibiting a mode energy with minimal localization, is observed. It is shown that this behavior is mainly driven by the energy and thickness dependence of the polarizability of the individual NPs.
KW - Gold Nanoparticles
KW - Surface plasmons
KW - Electron enerdy loss spectroscopy (EELS)
KW - scanning transmission electron microscopy
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-647230
DO - https://doi.org/10.1103/44nk-6bp2
SN - 2643-1564
VL - 7
IS - 043053
EP - 4
PB - American Physical Society
AN - OPUS4-64723
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Homann, Christian
A1 - Peeters, Régis
A1 - Mirmajidi, Hana
A1 - Berg, Jessica
A1 - Fay, Michael
A1 - Rodrigues, Lucas Carvalho Veloso
A1 - Radicchi, Eros
A1 - Jain, Akhil
A1 - Speghini, Adolfo
A1 - Hemmer, Eva
T1 - Rapid microwave-assisted synthesis of morphology-controlled luminescent lanthanide-doped Gd2O2S nanostructures
N2 - Gadolinium oxysulfide (Gd2O2S) is an attractive material of demonstrated suitability for a variety of imaging applications, leveraging its magnetic, scintillating, and luminescent properties, particularly when doped with optically active lanthanide ions (Ln3+). For many of these applications, control over size and morphology at the nanoscale is crucial. This study demonstrates the rapid microwave-assisted Synthesis of colloidal Ln2O2S (Ln = Gd and dopants Yb, Er, Tb) nanostructures in as little as 20 min. Structural characterization using X-ray diffraction analysis (XRD), Raman spectroscopy, as well as Transmission electron microscopy (TEM), including elemental mapping via energy dispersive X-ray spectroscopy (EDS), unveiled the key role of elemental sulphur (S8) in the reaction mixtures for materials growth. By systematically varying the Ln-to-S ratio from 1 : 0.5 to 1 : 15, controlled morphologies ranging from triangular nanoplatelets to berry- and flower-like shapes were achieved. Doping with Er3+/Yb3+ endowed the nano-triangles with upconverting and near-infrared emitting properties. Tb3+-doped Gd2O2S exhibited the characteristic green Tb3+ emission under UV excitation, while also showing X-ray excited optical luminescence (XEOL), rendering the material interesting as a potential nano-scintillator.
KW - Upconversion
KW - Microwave-assisted synthesis
KW - Synthesis
KW - Fluorescence
KW - Nano
KW - Particle
KW - NIR
KW - XRD
KW - X-ray fluoressence
KW - Morphology control
KW - Raman
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-647907
DO - https://doi.org/10.1039/D5TC01646K
SN - 2050-7526
VL - 13
IS - 35
SP - 18492
EP - 18507
PB - Royal Society of Chemistry (RSC)
AN - OPUS4-64790
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Adamski, Paweł
A1 - Zgrzebnicki, Michał
A1 - Albrecht, Aleksander
A1 - Jurkowski, Artur
A1 - Wojciechowska, Agnieszka
A1 - Ekiert, Ewa
A1 - Sielicki, Krzysztof
A1 - Mijowska, Ewa
A1 - Smales, Glen J.
A1 - Maximenko, Alexey
A1 - Moszyński, Dariusz
T1 - Ammonia synthesis over γ-Al2O3 supported Co-Mo catalysts
N2 - Novel ammonia synthesis catalysts are sought due to energetic transformation and increasing environmental consciousness. Materials containing cobalt and molybdenum are showing state-of-art activities in ammonia synthesis. The application of γ-alumina support was proposed to enhance the properties of Co-Mo nanoparticles. The wet impregnation of the support was conducted under reduced pressure. The active catalysts were obtained by ammonolysis of precursors. The chemical and phase composition, as well as morphology, porosity, and surface composition of precursors and catalysts, were characterized. The Co-Mo nanoparticles phase composition as well as their size and dispersion were determined using X-ray absorption spectroscopy utilizing synchrotron radiation, electron microscopy, and X-ray scattering. The catalytic activity was tested in the ammonia synthesis process under atmospheric pressure. The activity and stability of the supported catalysts were compared with unsupported cobalt molybdenum nitride Co3Mo3N, revealing the superiority of the present approach.
KW - Ammonia synthesis
KW - Supported catalyst
KW - Cobalt molybdenum nitrides
KW - Scattering
KW - X-ray scattering
KW - Gamma-alumina
KW - Stability
PY - 2025
DO - https://doi.org/10.1016/j.mcat.2025.114907
SN - 2468-8231
VL - 575
SP - 1
EP - 9
PB - Elsevier B.V.
AN - OPUS4-64827
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Voss, Heike
A1 - Zahedi-Azad, Setareh
A1 - Ernst, Owen C.
A1 - Lucaßen, Jan
A1 - Mann, Guido
A1 - Bonse, Jörn
A1 - Boeck, Torsten
A1 - Martin, Jens
A1 - Schmid, Martina
A1 - Krüger, Jörg
T1 - Chemical vapor deposition of indium precursors for solar microabsorbers using continuous laser radiation
BT - A, Materials science & processing
N2 - Localized deposition of indium on an amorphous glass surface covered with a thin molybdenum layer is demonstrated utilizing laser-assisted chemical vapor deposition. A continuous-wave laser causes a temperature rise on the molybdenum layer resulting in the selective aggregation of liquid and ultimately crystalline structures of indium. The formation sites of the indium are determined by the decomposition of gaseous trimethylindium. The deposited indium islands can serve as precursors and could be further processed into compound semiconductors like CuInSe2 for micro-concentrator solar cells. The experimental investigations were supported by theoretical simulations of the laser heating process to calculate the local temperature distribution on the surface of the molybdenum-covered glass substrate.
KW - Laser-assisted Chemical Vapor Deposition
KW - CW Laser
KW - Indium Islands
KW - Micro-concentrator Solar Cell
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-641069
DO - https://doi.org/10.1007/s00339-025-08895-z
SN - 0947-8396
VL - 131
SP - 1
EP - 10
PB - Springer
CY - Berlin ; Heidelberg [u.a.]
AN - OPUS4-64106
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Xu, Alan
A1 - Moschetti, Michael
A1 - Miskovic, David
A1 - Wei, Tao
A1 - Ionescu, Mihail
A1 - Wang, Zhiyang
A1 - Palmer, Tim
A1 - Bhattacharyya, Dhriti
A1 - He, Peidong
A1 - Li, Xiaopeng
A1 - Gludovatz, Bernd
A1 - Ferry, Michael
T1 - Improved irradiation resistance of a low activation refractory medium entropy alloy, VCrFeW0.2, for fusion applications demonstrated by micro-tensile testing
N2 - An, as cast, VCrFeW0.2 refractory medium entropy alloy (RMEA) was designed for fusion reactor divertor applications, focusing on reduced cost, low activation and compositional stability (low transmutation rates). The as-cast alloy was irradiated to a fluence of 5.6 × 10^17 ions/cm^2 at room temperature with 5 MeV helium ions whose energy have been uniformly attenuated to 0.4 MeV and 5 MeV via energy degradation device prior to sample irradiation. Pre and post irradiation, its mechanical properties were evaluated micro-tensile testing. Prior to irradiation, the VCrFeW0.2 alloy demonstrated good strength and ductility, with a yield strength of 1464 MPa and strain to UTS (\sigma_UTS) of 4.6 %, maintaining comparable strength to pure tungsten (1403 MPa) but with greater strain to UTS (1.3 %). Post irradiation, the VCrFeW0.2 alloy exhibited remarkable damage resistance; its strength increased by only ∼160 MPa, and it retained strain to UTS with a \sigma_UTS of 2.9 %. It performed better than pure tungsten tested under identical irradiation conditions where there was ∼1800 MPa increase in yield strength and a complete loss of plasticity. The micro-tensile results were supported by nanoindentation tests and Vickers hardness testing was also undertaken to show the yield strength values are representative of macro scale, bulk behavior. TEM and comparison with existing literature on RMEA/RHEA are presented here to understand the reason for difference in performance between VCrFeW0.2 alloy and pure tungsten.
KW - Refractory medium entropy alloys
KW - Fusion reactor materials
KW - Irradiation resistance
KW - Micro-tensile testing
KW - Helium ion damage
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-645322
DO - https://doi.org/10.1016/j.ijrmhm.2025.107481
SN - 0263-4368
VL - 134
SP - 1
EP - 16
PB - Elsevier Ltd.
CY - Netherlands
AN - OPUS4-64532
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - George, Janine
T1 - Robust data generation, heuristics and machine learning for designing sustainable materials
N2 - Despite advances in computational materials design, simulating large systems—such as defects, interfaces, or amorphous states—with quantum-chemical accuracy remains a major challenge.[1] Machine learning (ML) methods are emerging as powerful tools to overcome these limitations, enabling scalable and accurate modeling beyond traditional quantum-chemical approaches.[2] They also open new avenues for discovering non-toxic, earth-abundant alternatives to existing materials and can be combined with self-driving labs. [3] There are nowadays robust data generation strategies that underpin the development and benchmarking of ML models. [4,5]atomate2 I will focus on such strategies for quantum-chemical bonding analysis and ML interatomic potentials in my talk. Quantum-chemical bonding descriptors can be effectively used in ML models to predict phononic properties. [6] ML interatomic potentials offer a powerful approach for predicting energies, forces, and stresses—but their performance hinges on high-quality training data. Our automated framework, autoplex, enables diverse and scalable training workflows, from random structure searches for general-purpose models to phonon-aware pipelines for high-accuracy predictions.[7] While quantum chemistry excels in many domains, properties like magnetism and synthesizability remain elusive. Here, heuristics or leveraging experimental data for ML offer promising alternatives.[8,9]
T2 - Advanced Materials Safety 2025
CY - Dresden, Germany
DA - 04.11.2025
KW - Nano Particles
KW - Machine Learning
KW - Automation
KW - Materials Design
KW - Sustainability
KW - Material Safety
PY - 2025
AN - OPUS4-64599
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Hörmann, Anja Franziska
T1 - extending the MOUSE in spirit: lifecycle of a GIXS experiment
N2 - We present the new grazing incidence mode at the MOUSE, which adapts and extends the MOUSE methodology developed for transmission X-ray scattering (Smales and Pauw, 2021). Our methodology begins and ends in discussion with our users and embraces automation for reproducible experiments including sample organisation, instrument configuration, documentation and data processing. This poster presents methodological innovations and challenges.
T2 - GISAXS 2025
CY - Hamburg, Germany
DA - 27.10.2025
KW - Grazing incidence
KW - X-ray scattering
KW - Experimental methodology
PY - 2025
AN - OPUS4-64694
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Fischer, Tim
A1 - Huber, Norbert
T1 - Designing microcompression experiments for nanoporous metals via computational plasticity
N2 - Micropillar compression testing is essential for understanding bulk metal plasticity at small scales and has emerged as a key technique for evaluating nanoporous metals like nanoporous gold (NPG). To support experimental design, we present a computational plasticity study on single crystal NPG micropillars, systematically examining four extrinsic factors: pillar height-to-diameter ratio, taper angle, friction coefficient, and misalignment angle. The study reveals that NPG exhibits similar trends to its bulk counterpart but is less prone to post-yield buckling in unstable crystal orientations. For optimal NPG pillar stability, an aspect ratio of is recommended and a moderate taper angle to prevent artificial stiffening and yielding. Even minimal friction enhances stability, while buckling is mainly governed by misalignment, requiring to also avoid underestimating the elastic modulus.
KW - Nanoporous gold
KW - Microcompression
KW - Plasticity
KW - Finite element method
KW - Micromechanics
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-645317
DO - https://doi.org/10.1016/j.matdes.2025.114550
SN - 0264-1275
VL - 258
SP - 1
EP - 9
PB - Elsevier Ltd.
AN - OPUS4-64531
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Huber, Norbert
T1 - Perspectives and pitfalls in modeling of structure-property relationships using machine learning
N2 - Machine learning (ML) has been increasingly utilized to support microstructure characterization and predict mechanical properties. A successful ML model typically requires a comprehensive understanding of existing knowledge, expertise in translating this knowledge into meaningful input features, an effective ML architecture, and robust validation of the trained model. Despite the rapid growth in publications incorporating ML methods in recent years, there is limited literature specifically addressing nanoporous metals. The talk will give an overview on perspectives and pitfalls in modeling of structureproperty relationships using machine learning with focus on various challenges that arise from the specific nature of nanoporous metals including randomness of microstructure, image segmentation, lack of tomography data, feature engineering for property prediction, and implications for plasticity including anisotropic flow and arbitrary multiaxial loading on the lower scale of hierarchy. An outlook will be given on the perspectives of establishing a culture of open data, specifically towards curated data sets needed for training and validation of ML models. Potential use cases are the comparison of data from different sources, mining of more general relationships, and validation of models trained with computer generated data using experimental data.
T2 - 5th International Symposium on Nanoporous Materials by Alloy Corrosion
CY - Sendai, Japan
DA - 06.10.2025
KW - Nanoporous metals
KW - Machine learning
KW - Structure-properties relationship
KW - Materials design
PY - 2025
AN - OPUS4-64536
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Li, Yong
A1 - Hu, Kaixiong
A1 - Lilleodden, Erica T.
A1 - Huber, Norbert
T1 - Datasets for structural and mechanical properties of nanoporous networks from FIB reconstruction
N2 - This dataset paper presents a comprehensive archive of 3D tomographic reconstruction image files, volume mesh files for finite element simulations, and tabulated structural and mechanical properties data of nanoporous gold structures. The base material is nanoporous gold, fabricated using a dealloying process, with a solid fraction of approximately 0.30. The NPG samples with ligament sizes ranging from 20 nm to 400 nm were prepared by dealloying and by controlling the thermal annealing process. The original data consist of tomographic TIFF files acquired through Focused Ion Beam/Scanning Electron Microscopy (FIB/SEM) 3D reconstruction, as detailed in Philosophical Magazine 2016 96 (32-34), 3322-3335. At each ligament size, six sets of 3D tomographic images were obtained from different regions of the same sample to ensure representative data. New simulations and analyses were conducted based on the 3D image data. The resulting structural and mechanical property data of nanoporous gold are reported for the first time in this dataset paper. Volume meshing of the 3D reconstructed data was performed using Simpleware software. Structural parameters, including surface area, solid volume, and solid volume fraction of the nanoporous network, were extracted from the meshed volumes. Structural connectivity was assessed from the 3D microstructures. The meshed volumes were then used as input for finite element simulations performed in Abaqus to evaluate mechanical responses under uniaxial compression along all three principal axes respectively. From the resulting stress–strain curves, the Young’s modulus and yield strength of each structure were determined. Both elastic and plastic Poisson’s ratios were analyzed from true strain increments. This dataset includes the 3D tomographic images, corresponding volume mesh files, mechanical behavior data and tables summarizing the structural and mechanical properties. The archived data serve as a database for nanoporous network materials and can be reused for numerical simulations, additive manufacturing, and machine learning applications within the materials science community. All files are openly accessible via the TORE repository at https://doi.org/10.15480/882.15230
KW - Nanoporous gold
KW - Dealloying
KW - FIB/SEM tomography
KW - Finite element
KW - Volume mesh
KW - Young’s modulus
KW - Yield stress
KW - Poisson’s ratio
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-645330
DO - https://doi.org/10.1016/j.dib.2025.112152
SN - 2352-3409
VL - 63
SP - 1
EP - 14
PB - Elsevier Inc.
AN - OPUS4-64533
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - GEN
A1 - Li, Yong
A1 - Hu, Kaixiong
A1 - Lilleodden, Erica T.
A1 - Huber, Norbert
T1 - Datasets for structural and mechanical properties of nanoporous networks from FIB reconstruction
N2 - This dataset includes 3D tomographic reconstruction image files, volume mesh files for finite element simulations, and data on the structural and mechanical properties of nanoporous gold (NPG) structures. It serves as a supplement to a dataset paper, with the corresponding DOI provided in the “Related Identifiers” section. Detailed descriptions of the data, as well as the procedures for their preparation and curation, are presented in that paper.
The base material, nanoporous gold, was fabricated via a dealloying process and has a solid fraction of approximately 0.30. NPG samples with ligament sizes ranging from 20 nm to 400 nm were prepared through dealloying and subsequent thermal annealing. Tomographic TIFF files were obtained via Focused Ion Beam/Scanning Electron Microscopy (FIB/SEM) 3D reconstruction, with the procedure detailed in Philosophical Magazine (2016, 96(32–34), 3322–3335).
Based on the 3D image data, new simulations and analyses were performed. The resulting structural and mechanical property data of nanoporous gold are reported for the first time in the dataset paper and are archived here. This dataset provides a valuable database for the study of nanoporous network materials and can be reused for numerical simulations, additive manufacturing, and machine learning applications within the materials science community.
KW - Nanoporous gold
KW - Dealloying
KW - Coarsening
KW - FIB/SEM tomography
KW - Connectivity
KW - Finite element
KW - Volume mesh
KW - Young’s modulus
KW - Yield stress
KW - Poisson’s ratio
PY - 2025
DO - https://doi.org/10.15480/882.15230
PB - Technische Universität Hamburg Open Research
CY - Hamburg
AN - OPUS4-64534
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Wegner, Karl David
T1 - Advancing Short-Wave Infrared (SWIR) Emission
N2 - There is a growing interest in the exploitation of the short-wave infrared (SWIR), which refers to the wavelength band of light between 900 nm and 2500 nm. Luminophores that emit in the SWIR are used in various areas of telecommunications, photovoltaics, security systems (night vision), and in biomedicine. In particular for biomedical applications, the SWIR range is highly promising because light scattering, absorption, and autofluorescence of tissue and biological compounds are strongly reduced compared to the visible (400–700 nm) and NIR (~700–900 nm). The benefits of SWIR-emissive QDs have been demonstrated for a variety of applications, such as in thermal sensing, as photoelectrochemical biosensor, in in vivo vascular imaging, and for fluorescence-guided surgery.[1]
Full exploitation of SWIR photoluminescence (PL) imaging and sensing is currently hampered by i.) a lack of suitable advanced nanomaterials with a high PL quantum yield (PL QY) and a high brightness, that can be used safely in vivo and ii.) a lack of quantitative and reliable data on the optical properties of many SWIR emitters. Promising nanomaterials for the SWIR are heavy metal-free Ag2S quantum dots (QDs).
Aiming for the development of SWIR advanced nanomaterials with optimum performance, we have dived deeper into the photophysical processes occurring in these nanomaterials, thereby exploring in depth how the environment such as temperature, surface ligand composition, and the incorporation of transition metals influence the optical properties Ag2S QDs. We observed a strong enhancement of the SWIR emission of upon addition of metal ions such as Zn2+, yielding PL quantum yields of about 10% and thus making them highly suitable for non-invasive deep imaging of vascular networks and 3D fluid flow mapping.
T2 - Anakon 2025
CY - Leipzig, Germany
DA - 10.03.2025
KW - Quantum dots
KW - Nano
KW - Particle
KW - SWIR
KW - Fluorescence
KW - Temperature
KW - Ag2S
KW - Quality assuarance
KW - Ligand
KW - Sensor
PY - 2025
AN - OPUS4-62769
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Andresen, Elina
T1 - Lanthanide based multi element nanoparticles: a versatile platform for surface chemistry analysis and potential reference materials
N2 - The use of engineered nanoparticles of different size, shape, and composition is continuously increasing in the life and materials sciences. This calls for methods and reference materials enabling the reliable and accurate determination of nanoparticle size, particle size distribution, shape, number concentration, degree of aggregation and agglomeration in different environments as well as for nanoparticle dispersibility and stability.
We are currently building up and exploring a platform of lanthanide-based nanocrystals (LnNCs) with application-specifically tuned size, shape, composition, architecture, optical properties, and surface chemistry for emerging applications in life sciences. As a prerequisite for the broad applicability of these nanomaterials, we assess simple, robust, and easily upscaleable synthesis protocols for LnNCs with defined morphologies and tunable optical properties, and the short-term and long-term stability of LnNCs with selected surface coatings in aqueous environments under different application-relevant conditions.
T2 - Anakon 2025
CY - Leipzig, Germany
DA - 10.03.2025
KW - Nano
KW - Particle
KW - Method
KW - Lanthanide
KW - Synthesis
KW - Upconversion
KW - Ligand
KW - Quality assurance
KW - Particle number concentration
KW - Reference material
KW - Surface chemistry
PY - 2025
AN - OPUS4-62768
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Matiushkina, Anna
A1 - Abram, Sarah-Luise
A1 - Tavernaro, Isabella
A1 - Richstein, R.
A1 - Reithofer, M. R.
A1 - Andresen, Elina
A1 - Michaelis, Matthias
A1 - Koch, Matthias
A1 - Resch-Genger, Ute
T1 - Quantifying Citrate Surface Ligands on Iron Oxide Nanoparticles with TGA, CHN Analysis, NMR, and RP-HPLC with UV Detection
N2 - Although citrate is frequently used as a surface ligand for nanomaterials (NMs) such as metal, metal oxide, and lanthanide-based NMs in hydrophilic environments due to its biocompatibility and simple replacement by other more strongly binding ligands in postsynthetic surface modification reactions, its quantification on NM surfaces has rarely been addressed. Here, we present a multimethod approach for citrate quantification on iron oxide nanoparticles (IONPs) broadly applied in the life and material sciences. Methods explored include thermogravimetric (TGA) and elemental (CHN) analysis, providing citrate-nonspecific information on the IONP coating, simple photometry, and citrate-selective reversed-phase high-performance liquid chromatography (RP-HPLC) with absorption (UV) detection and quantitative nuclear magnetic resonance spectroscopy (qNMR). Challenges originating from the strongly absorbing magnetic NM and paramagnetic iron species interfering with optical and NMR Methods were overcome by suitable sample preparation workflows. Our multimethod approach to citrate quantification highlights the advantages of combining specific and unspecific methods for characterizing NM Surface chemistry and method cross-validation. It also demonstrates that chemically nonselective measurements can favor an overestimation of the amount of a specific surface ligand by signal contributions from molecules remaining on the NM surface, e.g., from particle synthesis, such as initially employed ligands and/or surfactants. Our results emphasize the potential of underexplored selective RPHPLC for quantifying ligands on NMs, which does not require a multistep sample preparation workflow such as qNMR for many NMs and provides a higher sensitivity. These findings can pave the road to future applications of versatile HPLC methods in NM characterization.
KW - Advanced material
KW - Functional group
KW - Iron oxide
KW - Ligand
KW - Nano
KW - Particle
KW - Quantification
KW - Surface analysis
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-648632
DO - https://doi.org/10.1021/acs.analchem.5c03024
SN - 0003-2700
VL - 97
IS - 36
SP - 19627
EP - 19634
PB - American Chemical Society (ACS)
CY - Washington, DC
AN - OPUS4-64863
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Würth, Christian
A1 - Resch-Genger, Ute
T1 - Absolute determination of photoluminescence quantum yields of scattering led converter materials how to get it right
N2 - Scattering luminescent materials dispersed in liquid and solid matrices and luminescent powders are increasingly relevant for fundamental research and industry. Examples are luminescent nano- and microparticles and phosphors of different compositions in various matrices or incorporated into ceramics with applications in energy conversion, solid-state lighting, medical diagnostics. A key performance parameter is the photoluminescence quantum yield (Φf), i.e., the number of emitted per number of absorbed photons. Φf of transparent luminophore solutions can be obtained relative to a fluorescence Φf standard of known Φf, meanwhile available as certified reference materials.[1] The determination of Φf of scattering liquid and solid samples requires, however, absolute measurements with an integrating sphere setup.
Fist we present the results of an interlaboratory comparison of 3 labs from academia and industry on measurements of transparent and scattering dye solutions and YAG:Ce optoceramics, an optical converter material, with commercial stand-alone integrating sphere setups of different illumination and detection geometries.[2] Second we present results for a series of 500 μm-thick polymer films containing different concentrations of photoluminescent and scattering YAG:Ce microparticles.[3] We systematically explored and quantified pitfalls of absolute Φf measurements with special emphasis dedicated to the influence of measurement geometry, optical properties of the blank for determining the number of incident photons absorbed by the sample, and sample-specific surface roughness. Matching Φf values could be easily obtained for transparent dye solutions and scattering dispersions with a blank with scattering properties closely matching those of the sample, Φf measurements of optoceramic samples with different blanks revealed substantial differences of more than 20 %. Our results further reveal that setup configurations can introduce systematic errors resulting in under- or overestimation of the absorbed photon flux and hence an under- or overestimation of Φf.
T2 - Shift 2025
CY - La Laguna, Tenerife, Spain
DA - 13.10.2025
KW - Quantum Yield
KW - LED Converter
KW - Luminescent
KW - Microparticles
PY - 2025
AN - OPUS4-64785
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Bresch, Harald
T1 - Nanoparticle Characterisation - The long way to standardisation
N2 - Diese Präsentation gibt einen Überblick über die Entwicklung der Nanopartikelforschung von ca. 2005 bis heute. Beginnend mit den Besonderheiten von Nanopartikeln und der Aufnahme in den menschlichen Körper über Messmethoden bis hin zur Entwicklung einer Prüfrichtlinie im Rahmen der OECD und einem Ausblick über die absehbaren digitalen Entwicklungen.
T2 - Abteilungsseminar der Abteilung 4
CY - Berlin, Germany
DA - 27.02.2025
KW - Nanomaterials
KW - Nano
KW - OECD
KW - Standardisierung
KW - Advanced Materials
PY - 2025
AN - OPUS4-64977
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - da Rocha, Morgana
A1 - Chaves, Eduardo
T1 - Assessment of Pd Nanoparticles as Chemical Modifiers and Preconcentration Agents for Cd Determination in River Water by HR-CS GFAAS
N2 - Cadmium is a heavy metal that can be hazardous to environmental and human health, even in trace levels.[1] In this way, the extraction and/or preconcentration of this element from environmental samples, such as river water, is important to obtain information about the composition and monitoring of potential contamination.[2] High-resolution continuum source graphite furnace atomic absorption spectrometry (HR-CS GFAAS) is widely used for Cd determination. However, the determination of this element at trace-level can be challenging, especially in complex matrices. Thus, nanoparticles (NPs) can be used as an alternative for the extraction and preconcentration of Cd in environmental samples, minimizing the potential interferences and improving the method´s limit of detection (LOD). Considering that Pd is also widely used as a “universal” chemical modifier, this project aims todevelop PdNPs capped with 3-mercaptopropionic acid (MPA) to assess its potential as a chemical modifier and preconcentration agent for Cd determination by HR-CS GF AAS in river water. In this way, the synthesis of PdNPs was performed in an aqueous medium by using ascorbic acid as a reducing agent. The characterization of PdNPs was performed by checking the size via dynamic light scattering (DLS), transmission electron microscopy (TEM), and inductively coupled plasma mass spectrometer in single particle mode (spICP-MS), where the median size was 56 ± 14 nm. The temperature program of HR-CS GFAAS was optimized for river water under three conditions: using Pd(NO3)2/Mg2+ (0.01%/0.5% m/v) as a chemical modifier (condition A), using Pd NPs as a chemical modifier (condition B), and without chemical modifiers (condition C). The pyrolysis and atomization temperatures for condition A were 900 and 1900 ºC, for condition B were 700 ºC and 1900 ºC, and for condition C were 500 and 1900ºC, respectively. Besides the temperature of pyrolysis for the universal chemical modifier being higher than that of PdNPs, using the PdNPs, the absorbance is significantly greater, according to the t-test for pairs, at a 95% confidence level. In addition, the evaluation of the preconcentration property of the PdNP was performed by adding 1 µg L-1 of Cd2+ in buffer pH 4 in two systems: one with and the other without PdNPs. After 1 h of stirring, both
systems were centrifuged at 3600 rpm for 10 min, and the absorbance in HR-CS GFAAS for Cd in both supernatants was evaluated. According to ANOVA from the t-test, at a 95% confidence level, there was a significant difference in the absorbance, indicating that Cd is interacting with the PdNPs. A multifactorial planning 2k, where k is the number of parameters of the extraction, which was time of extraction (10; 35; 60 min), Volume of Pd NPs (100; 300; 500 µL), pH (3; 5; 7), was used to evaluate the parameters with significant influence in the preconcentration of Cd2+. According to ANOVA, with 95% confidence, there is no lack of fit, and the parameters volume of PdNP and pH significantly influenced the response. In this way, the Doehlert methodology surface will be applied to both significant parameters. The goal is to achieve optimal conditions that increase the extraction efficiency of Cd2+ from environmental samples. The results indicate that the developed material is promising to use as a chemical modifier and for the preconcentration of Cd2+ in environmental samples.
T2 - 17th Rio Symposium on Atomic Spectrometry (RSAS 2025)
CY - Sao Pedro, Brazil
DA - 12.11.2025
KW - Pd Nanoparticles
KW - HR-CS GFAAS
KW - Cadmium Ion Sensing
KW - Particle Characterization
KW - Particle Surface
PY - 2025
AN - OPUS4-64997
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Batatia, Ilyes
A1 - Benner, Philipp
A1 - Chiang, Yuan
A1 - Elena, Alin M.
A1 - Kovács, Dávid P.
A1 - Riebesell, Janosh
A1 - Advincula, Xavier R.
A1 - Asta, Mark
A1 - Avaylon, Matthew
A1 - Baldwin, William J.
A1 - Berger, Fabian
A1 - Bernstein, Noam
A1 - Bhowmik, Arghya
A1 - Bigi, Filippo
A1 - Blau, Samuel M.
A1 - Cărare, Vlad
A1 - Ceriotti, Michele
A1 - Chong, Sanggyu
A1 - Darby, James P.
A1 - De, Sandip
A1 - Della Pia, Flaviano
A1 - Deringer, Volker L.
A1 - Elijošius, Rokas
A1 - El-Machachi, Zakariya
A1 - Fako, Edvin
A1 - Falcioni, Fabio
A1 - Ferrari, Andrea C.
A1 - Gardner, John L. A.
A1 - Gawkowski, Mikołaj J.
A1 - Genreith-Schriever, Annalena
A1 - George, Janine
A1 - Goodall, Rhys E. A.
A1 - Grandel, Jonas
A1 - Grey, Clare P.
A1 - Grigorev, Petr
A1 - Han, Shuang
A1 - Handley, Will
A1 - Heenen, Hendrik H.
A1 - Hermansson, Kersti
A1 - Ho, Cheuk Hin
A1 - Hofmann, Stephan
A1 - Holm, Christian
A1 - Jaafar, Jad
A1 - Jakob, Konstantin S.
A1 - Jung, Hyunwook
A1 - Kapil, Venkat
A1 - Kaplan, Aaron D.
A1 - Karimitari, Nima
A1 - Naik, Aakash A.
A1 - Csányi, Gábor
T1 - A foundation model for atomistic materials chemistry
N2 - Atomistic simulations of matter, especially those that leverage first-principles (ab initio) electronic structure theory, provide a microscopic view of the world, underpinning much of our understanding of chemistry and materials science. Over the last decade or so, machine-learned force fields have transformed atomistic modeling by enabling simulations of ab initio quality over unprecedented time and length scales. However, early machine-learning (ML) force fields have largely been limited by (i) the substantial computational and human effort required to develop and validate potentials for each particular system of interest and (ii) a general lack of transferability from one chemical system to the next. Here, we show that it is possible to create a general-purpose atomistic ML model, trained on a public dataset of moderate size, that is capable of running stable molecular dynamics for a wide range of molecules and materials. We demonstrate the power of the MACE-MP-0 model—and its qualitative and at times quantitative accuracy—on a diverse set of problems in the physical sciences, including properties of solids, liquids, gases, chemical reactions, interfaces, and even the dynamics of a small protein. The model can be applied out of the box as a starting or “foundation” model for any atomistic system of interest and, when desired, can be fine-tuned on just a handful of application-specific data points to reach ab initio accuracy. Establishing that a stable force-field model can cover almost all materials changes atomistic modeling in a fundamental way: experienced users obtain reliable results much faster, and beginners face a lower barrier to entry. Foundation models thus represent a step toward democratizing the revolution in atomic-scale modeling that has been brought about by ML force fields.
KW - Materials Design
KW - Thermal Conducitivity
KW - Nanoparticles
KW - Batteries
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-647829
DO - https://doi.org/10.1063/5.0297006
SN - 0021-9606
VL - 163
IS - 18
SP - 1
EP - 89
PB - AIP Publishing
AN - OPUS4-64782
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Bresch, Harald
T1 - The digital product passport
N2 - This presentation contains information for industry and the scientific communitiy about the new digital product passport and the demands from the EU. Furthermore a short overview is given about the different supporting activities which are currently under developement by BAM.
T2 - 3. Netzwerktag Cluster Nanotechnologie
CY - Würzburg, Germany
DA - 02.07.2025
KW - DPP
KW - ESPR
KW - Product Passport
KW - Ökodesignrichtlinie
KW - DMP
PY - 2025
AN - OPUS4-64964
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - RPRT
A1 - Knigge, Xenia
A1 - Radnik, Jörg
T1 - Advanced materials for the energy transition
N2 - The climate crisis is the burning issue of our time. In order to avert the impending consequences, global efforts are being made in a wide variety of social and scientific fields. This report looks at a small part of these efforts, a technical aspect, namely the question of which AdMa are currently considered in techniques to support the energy transition. AdMa, i.e. materials that are rationally designed to have new or enhanced properties, and/or targeted or enhanced structural features, are used in all sectors of the energy transition. Questions of energy generation, storage and saving are considered here. This report is based on literature research and contains a general compilation of various AdMa that are used in the energy transition or are being researched for this purpose. From this compilation, ten materials that are considered particularly relevant for various reasons were selected and examined in more detail in relation to their use. The specific question here lies in the conflicting objective that the development of technologies for the energy transition is welcomed, but the use of AdMa may entail possible challenges in view of chemical safety as well as sustainability and circular economy.
KW - Energy generation
KW - Energy saving
KW - Eneergy storage
KW - Energy transportation
PY - 2025
DO - https://doi.org/10.60810/openumwelt-7853
SN - 1862-4804
VL - 83
SP - 1
EP - 64
PB - Umweltbundesamt
CY - Dessau-Roßlau
AN - OPUS4-63529
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Schilling, Markus
T1 - Towards Structured Data Spaces: Prototypical Application of Semantic Technologies as a Driver for Innovation in Materials Science
N2 - In the pursuit of advancing development and digitalization within materials science, ensuring quality assurance, interoperability, and adherence to FAIR principles is significant. To address these aspects, semantic technologies are employed for storage, processing, and contextualization of data, offering machine-actionable and human-readable knowledge representations crucial for data management.
This presentation showcases the prototypical application of generic approaches of knowledge representation in materials science. It includes the design and documentation of graph patterns that may be compiled into rule-based semantic shapes. The development and application of the PMD Core Ontology 3.0 (PMDco 3.0) tailored for materials science is highlighted. Its integration into daily lab life is demonstrated through its functional incorporation into electronic lab notebooks (ELN). Examples of material processing and standardized mechanical testing illustrate how knowledge graph operations enhance ELN capabilities, providing a generalizable unified approach for managing diverse experimental data from different sources with automation potentials.
T2 - TMS Specialty Congress 2025
CY - Anaheim, CA, USA
DA - 15.06.2025
KW - Semantic Data
KW - Data Integration
KW - Digitalization
KW - Data Interoperability
KW - Plattform MaterialDigital
PY - 2025
AN - OPUS4-63401
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Fernandez-Poulussen, D.
A1 - Hodoroaba, Vasile-Dan
T1 - Holistic, reliable and practical Characterization Framework for Graphene Family Materials, a correlated approach including Imaging based techniques
N2 - ACCORDs is an Horizon Europe project working in the development of an imaging-based characterization framework (ACCORDs framework) for the holistic correlative assessment of Graphene Family Materials (GFMs) as a representative of 2D nanomaterials (NMs) to assess and predict 2D NMs health and environmental risks. The ACCORDs framework will operationalise safe and sustainable by design (SSbD) strategies proposed in past or ongoing H2020 projects or within OECD by correlating low-, medium-, and high-resolution physico-chemical-biological imaging-based methods with non-imaging methods in a tiered approach. ACCORDs will deliver the ACCORDs framework and user guidance, new imaging-based characterisation methods, reference in vitro tests, new reference 2D NMs for different matrices, a new minimum information reporting guideline for FAIR data sharing and reuse of images as well as an atlas with reference images for diagnostics of compromised safety of GFMs/GFM products. The new guidelines and standard proposals will be submitted to standardisation bodies to allow creation of regulatory ready products. The novelty of ACCORDs is in translating the principles of medical imaging-based diagnostics to 2D material hazard diagnostics. ACCORDs will accelerate industrial sectors in the area of aviation, marine construction, drone production, flexible electronics, photovoltaics, photocatalytics and print inks-based sensors. The value ACCORDs proposes to the graphene industry are practical, easy, imaging-based tools for GFM quality monitoring next to the production line with a possibility to be correlated with advanced highresolution imaging characterization methods in case hazard i.e. deviation from controls (benchmark values) are diagnosed. The ACCORDs framework and tools will contribute to the European Green Deal by addressing the topic: “Graphene: Europe in the lead” and to a new European strategy on standardization, released on 2nd February, 2022
T2 - Joint Regulatory Risk Assessors Summit – Advancing Safety & Sustainability Assessments of Advanced Materials
CY - Paris, France
DA - 19.06.2025
KW - Graphene-related 2D materials (GR2M)
KW - Imaging
KW - SSbD
KW - ACCORDs
PY - 2025
UR - https://macrame-project.eu/macrame-meetings-workshops/jointrras/#Agenda
AN - OPUS4-63660
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Radnik, Jörg
T1 - Investigation of Fe-Ni-O nanoparticles for water splitting
N2 - This study investigates the effect of varying iron-to-nickel ratios on the catalytic performance of Fe-Ni oxide nanoparticles (NPs) for the oxygen evolution reaction (OER). Addressing the issue of high energy wastage due to large overpotentials in OER, we synthesized and characterized different NP catalysts with different Fe: Ni oxide ratios. Transmission Electron Microscopy (TEM), Energy Dispersive X-ray Spectroscopy (EDS), and X-ray Diffraction (XRD) were employed to determine the morphology, elemental and phase composition of the NPs. Furthermore, in-depth profiling with X-rayPhotoelectron Spectroscopy (XPS) and Hard X-ray Photoelectron Spectroscopy (HAXPES) revealedthat iron predominantly exists as oxide, while nickel exhibits both metallic and oxidic forms depending on the Fe content. XPS indicated an enrichment of iron at the NP surface, whereas HAXPES and EDSdata agreed on the bulk stoichiometry.
T2 - PhI European User Meeting 2025
CY - Eibelstadt, Germany
DA - 29.04.2025
KW - Oxygen evolution reaction
KW - In depth analysis
KW - (Hard) X-ray Photoelectron Spectroscopy
PY - 2025
AN - OPUS4-63334
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Fagan, J.
A1 - Hodoroaba, Vasile-Dan
T1 - VAMAS TWA 34 Nanoparticle Populations Combined Projects P15 and P16
N2 - The progress in the VAMAS Project #15 "Measurement of particle size and shape distribution of bipyramidal titania including deposition from liquid suspension" within TWA 34 Nanoparticle Populations is presented with highlight of the following points:
- Determine and compare particle size and shape distribution by means of electron microscopy (SEM, TEM, STEM-in-SEM), atomic force microscopy (AFM) and small angle X-ray scattering (SAXS).
- Determine uncertainty induced by deposition protocol from liquid suspension with comparison to known values from a prior ILC with already deposited nanoparticles on TEM grids.
- Provide comparative validation of protocols for the techniques other than TEM.
Further, the VAMAS/TWA 34 Project #16 "Measurement of (relative) number concentration of bimodal silica nanoparticles including deposition from liquid suspension" is presented. Follwowing points are discusssed:
- Validate the performance of imaging methods to measure the relative number concentration by electron microscopy (SEM, TEM) and atomic force microscopy (AFM) and two modes of bimodal (30 and 60 nm) silica nanoparticles
- Validate the performance of small angle X-ray scattering (SAXS) for the traceable measurement of the number concentration of the two modes.
- Discussion of sample preparation issues
- Publication of the results in 2026
T2 - Versailles Project on Advanced Materials and Standards (VAMAS) 50th Steering Committee Meeting
CY - London, United Kingdom
DA - 14.09.2025
KW - VAMAS
KW - Interlaboratory comparison
KW - Particle size and shape distribution
KW - Particle number concentration
KW - Standardisation
PY - 2025
UR - https://www.vamas.org/twa34/index.html
AN - OPUS4-64234
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Hodoroaba, Vasile-Dan
T1 - VAMAS Regional Report Advanced Materials Germany 2025
N2 - Regional standardisation activities and how VAMAS can help in any way to promote activities are reported. Activities related to organisational updates, government initiatives/priorities (especially related to Advanced Materials), details of any strategy documents publicly available, networks within Germany and how we engage are presented.
T2 - Versailles Project on Advanced Materials and Standards (VAMAS) 50th Steering Committee Meeting
CY - London, United Kingdom
DA - 14.09.2025
KW - VAMAS
KW - Interlaboratory comparison
KW - Advanced materials
KW - Standardisation
PY - 2025
AN - OPUS4-64232
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Narayanan, M.M.
A1 - Nicolai, M.
A1 - Prager, J.
T1 - C9-a5 - Optimization of Low-Frequency Shear Wave Transducers for Guided Wave Applications
N2 - Development of ultrasonic transducers for the excitation of a torsional mode T(0,1) mode in a large pipe of the material typical of actual oil/gas pipelines is discussed. Towards this,16 ultrasonic transducers are designed and fabricated using shear plates of PIC 255 material, backing mass of tungsten-epoxy composite and brass shims as wear plates. The transducers are qualified using Laser Doppler Vibrometry. Then, the transducers are embedded in a springloaded ring and tested on a pipe using a multi-channel ultrasonic system. The results show the successful excitation of T(0,1) mode and it is seen to propagate for distance of 60 m with a good SNR.
T2 - 2025 ICU PADERBORN - 9th International Congress on Ultrasonics
CY - Paderborn, Germany
DA - 21.09.2025
KW - Ultrasonic guided waves
KW - Torsional mode
KW - Shear PZT plates
KW - Ring array transducer design
KW - Pipe testing
PY - 2025
DO - https://doi.org/10.5162/Ultrasonic2025/C9-a5
SP - 223
EP - 226
PB - AMA Service GmbH
AN - OPUS4-65356
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Zeipert, H.
A1 - Nellius, T.
A1 - Schönlau, N.
A1 - Wippermann, M.
A1 - Claes, L.
A1 - Henning, B.
A1 - Nicolai, Marcel
A1 - Prager, J.
T1 - C6-a3 - Monitoring the curing process of adhesive bonds using selective excitation of guided ultrasonic waves
N2 - A measurement setup for the selective excitation of guided ultrasonic waves in adhesively bonded plates is introduced. Changes of the dispersive behaviour of the guided waves during the curing process is known to be accompanied by a change in the propagating waves group velocities. The proposed measurement setup is used to monitor that change during the curing process of an aluminium-epoxy-polycarbonate bond.
T2 - 2025 ICU PADERBORN - 9th International Congress on Ultrasonics
CY - Paderborn, Germany
DA - 21.09.2025
KW - Ultrasonic guided waves
KW - Selective excitation
KW - Non-destructive testing
KW - Adhesive bonding
KW - Condition monitoring
PY - 2025
DO - https://doi.org/10.5162/Ultrasonic2025/C6-a3
SP - 207
EP - 210
PB - AMA Service GmbH
AN - OPUS4-65357
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - del Rocío Silva-Calpa, Leydi
A1 - de Souza Bernardes, Andrelaine
A1 - de Avillez, Roberto Ribeiro
A1 - Smales, Glen J.
A1 - Camarena, Mariella Alzamora
A1 - Ramos Moreira, Carla
A1 - Zaitsev, Volodymyr
A1 - Archanjo, Braulio Soares
A1 - Letichevsky, Sonia
T1 - From support to shell: An innovative design of air-stable nano zero-valent iron–nickel catalysts via structural self-assembly
N2 - This work presents the design of air-stable core–shell zero-valent iron–nickel nanofilaments supported on silica and zeolite, developed to overcome the oxidation limitations of nano zero-valent iron in environmental catalysis. The nanofilaments feature ∼ 100 nm iron–nickel cores surrounded by ultrafine iron-rich threads embedded with aluminates and silicates, originating from partial support dissolution during synthesis. By varying the iron reduction time, three catalysts were prepared: one on silica reduced for 30 min, and two on zeolite reduced for 30 and 15 min. They were thoroughly characterized using nitrogen physisorption, X-ray diffraction, electron microscopy with elemental analysis, Mössbauer spectroscopy, and small-angle X-ray scattering. The zeolite-supported catalyst reduced for 15 min showed the highest activity for hexavalent chromium reduction (rate constant 8.054 min−1), attributed to a higher fraction of reactive iron–nickel phases formed under shorter reduction. Its tailored core–shell structure improves air stability and surface reactivity, highlighting its potential as a next-generation zero-valent iron nanocatalyst for aqueous remediation
KW - nanofilaments
KW - Core–shell nanostructures
KW - Air-stable nanomaterials
KW - Structure-controlled FeNi nanoparticles
KW - Hexavalent chromium reduction
KW - X-ray scattering
KW - MOUSE
PY - 2025
DO - https://doi.org/10.1016/j.mtcomm.2025.114142
SN - 2352-4928
VL - 49
SP - 1
EP - 15677
PB - Elsevier Ltd.
AN - OPUS4-65087
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Berry, Charlotte A.
A1 - Reinart, Katre
A1 - Smales, Glen J.
A1 - Wilkinson, Holly N.
A1 - Hardman, Matthew J.
A1 - Marchesini, Sofia
A1 - Lee, William
A1 - Nery, Eveliny Tomás
A1 - Moghaddam, Zarrin
A1 - Hoxha, Agron
A1 - Felipe-Sotelo, Mónica
A1 - Gutierrez-Merino, Jorge
A1 - Carta, Daniela
T1 - Hierarchically porous copper and gallium loaded sol–gel phosphate glasses for enhancement of wound closure
N2 - In this work, we have developed hierarchically porous phosphate-based glasses (PPGs) as novel materials capable of promoting wound closure and simultaneously delivering antibacterial effects at the glass-biological tissue interface. PPGs are characterised by extended porosity, which enhances the controlled release of therapeutic ions, whilst facilitating cell infiltration and tissue growth. Two series of PPGs in the systems P2O5–CaO–Na2O–CuO and P2O5–CaO–Na2O–Ga2O3 with (CuO and Ga2O3 0, 1, 5 and 10 mol%) were manufactured using a supramolecular sol–gel synthesis strategy. Significant wound healing promotion (up to 97%) was demonstrated using a human ex vivo wound model. A statistically significant reduction of the bacterial strains Staphylococcus aureus and Escherichia coli was observed in both series of PPGs, particularly those containing copper. All PPGs exhibited good cytocompatibility on keratinocytes (HaCaTs), and analysis of PPG dissolution products over a 7-day period demonstrated controlled release of phosphate anions and Ca, Na, Cu, and Ga cations. These findings indicate that Cu- and Ga-loaded PPGs are promising materials for applications in soft tissue regeneration given their antibacterial capabilities, in vitro biocompatibility with keratinocytes and ex vivo wound healing properties at the biomaterial-human tissue interface.
KW - Porous glass
KW - Phosphates
KW - Wound healing materials
KW - Antibacterial
KW - X-ray scattering
KW - MOUSE
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-650867
DO - https://doi.org/10.1039/d5tb01945a
SN - 2050-750X
VL - 13
IS - 48
SP - 15662
EP - 15677
PB - Royal Society of Chemistry (RSC)
AN - OPUS4-65086
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Sun, Yijuan
A1 - Pérez-Padilla, Víctor
A1 - Valderrey, Virginia
A1 - Bell, Jérémy
A1 - Gawlitza, Kornelia
A1 - Rurack, Knut
T1 - Ratiometric detection of perfluoroalkyl carboxylic acids using dual fluorescent nanoparticles and a miniaturised microfluidic platform
N2 - The widespread contamination of soil and water with perfluoroalkyl substances (PFAS) has caused considerable societal and scientific concern. Legislative measures and an increased need for remediation require effective on-site analytical methods for PFAS management. Here we report on the development of a green-fluorescent guanidine-BODIPY indicator monomer incorporated into a molecularly imprinted polymer (MIP) for the selective detection of perfluorooctanoic acid (PFOA). Complexation of PFOA by the indicator, which is mediated by concerted protonation-induced ion pairing-assisted hydrogen bonding, significantly enhances fluorescence in polar organic solvents. The MIP forms as a thin layer on silica nanoparticles doped with tris(bipyridine)ruthenium(II) chloride, which provides an orange emission signal as internal reference, resulting in low measurement uncertainties. Using a liquid-liquid extraction protocol, this assay enables the direct detection of PFOA in environmental water samples and achieves a detection limit of 0.11 µM. Integration into an opto-microfluidic system enables a compact and user-friendly system for detecting PFOA in less than 15 minutes.
KW - PFAS
KW - Molecular imprinting
KW - Microfluidics
KW - Fluorescence
KW - Onsite assay
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-650270
DO - https://doi.org/10.1038/s41467-025-66872-9
SN - 2041-1723
VL - 16
IS - 1
SP - 1
EP - 16
PB - Springer Science and Business Media LLC
AN - OPUS4-65027
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Kostenko, Yevgen
T1 - Harmonizing Viscoplastic Material Model Application within the BMBF-Project “DigitalModelling” of the Platform Material Digital- Basic Idea, General Strategy and Current Status
N2 - For decades, Germany stands for excellent cutting-edge research in the field of so-called higher-value constitutive visco-plastic material models and can draw on a large and globally unique pool of material data. However, both the data and the model structure are extremely heterogeneous and sometimes fundamentally different from research center to research center and from industrial partner to industrial partner. To address the heterogeneity in the material model landscape appropriately, an adaptable material model for the specific application and the specific material is required. The relevant parameters for the adapted material model must be identified as objectively and automatically as possible. To achieve a potentially real-time capable implementation, the material model equation system should be abstracted.
The “DigitalModeling” project, organized within the German Platform initiative Material Digital, aims to create a standard and an interface that harmonize the scientific and technical development of constitutive, visco-plastic material models, increase their visibility and maximize the productivity of future research funding. This presentation summarizes the basic idea, the strategy behind it as well as the current status of the project, which was started beginning of 2024.
T2 - vgbe Workshop with Technical Exhibition Materials & Quality Assurance
CY - Bergen, Norway
DA - 07.05.2025
KW - Visco-plastic Material Model
KW - Simulation Workflows
KW - Ontologies
KW - Digitalization
PY - 2025
AN - OPUS4-64043
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Oskoei, Párástu
A1 - Afonso, Rúben
A1 - Bastos, Verónica
A1 - Nogueira, João
A1 - Keller, Lisa-Marie
A1 - Andresen, Elina
A1 - Saleh, Maysoon I.
A1 - Rühle, Bastian
A1 - Resch-Genger, Ute
A1 - Daniel-da-Silva, Ana L.
A1 - Oliveira, Helena
T1 - Upconversion Nanoparticles with Mesoporous Silica Coatings for Doxorubicin Targeted Delivery to Melanoma Cells
N2 - Melanoma is one of the most aggressive skin cancers and requires innovative therapeutic strategies to overcome the limitations of conventional therapies. In this work, upconversion nanoparticles coated with mesoporous silica and functionalized with folic acid (UCNP@mSiO2-FA) were developed as a targeted nanocarrier system for the delivery of doxorubicin (DOX). The UCNPs were synthesized via thermal decomposition, coated with mesoporous silica shells, and functionalized with folic acid (FA) to enable receptor-mediated targeting. DOX was then loaded into the mesoporous silica coating by adsorption, yielding UCNP@mSiO2-FA-DOX. The different UCNPs were characterized for size, composition, colloidal stability, and loading and release of DOX. This comprehensive physicochemical characterization confirmed a high DOX loading efficiency and a slightly increased drug release under acidic conditions, mimicking the tumour microenvironment. In vitro assays using four melanoma cell lines (A375, B16-F10, MNT-1, and SK-MEL-28) revealed an excellent biocompatibility of UCNP@mSiO2-FA and a significantly higher cytotoxicity of UCNP@mSiO2-FA-DOX compared to unloaded UCNPs, in a dose-dependent manner. Cell cycle analysis demonstrated G2/M phase arrest after treatment with UCNP@mSiO2-FA-DOX, confirming its antiproliferative effect. Overall, UCNP@mSiO2-FA-DOX represents a promising nanoplatform for targeted melanoma therapy, combining active tumour targeting and enhanced anticancer efficacy.
KW - Fluorescence
KW - Synthesis
KW - Nano
KW - Particle
KW - Silica
KW - Cell
KW - Uptake
KW - Drug
KW - Characterization
KW - DOX
KW - Imaging
KW - Toxicity
KW - Release
KW - pH
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-653596
DO - https://doi.org/10.3390/molecules31010074
SN - 1420-3049
VL - 31
IS - 1
SP - 1
EP - 18
PB - MDPI AG
AN - OPUS4-65359
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Madbouly, Loay Akmal
T1 - Chemical analysis of commercial functionalized graphene along the production process
N2 - Graphene has been commercialized for over a decade. For many applications like flexible electronics, coating of different materials like paper or for textiles, it used in the form of suspensions or inks. Functionalization enables tailoring the properties of graphene, such as the sheet resistance. X-ray photoelectron spectroscopy (XPS) and Raman spectroscopy are used to characterize the chemical composition of graphene flakes, functionalized and otherwise. In this study, we investigate the following set of commercial materials: fluorine-functionalized graphene (F-graphene) and nitrogen-functionalized graphene (N-graphene) as well as unfunctionalized graphene (G-graphene, as the starting material) in the forms of powders, suspensions, and inks, the latter as the final commercial product. Raman spectroscopy and XPS are complementary techniques. Our results obtained from Raman spectroscopy confirmed the existence of graphene structures in all samples investigated and provided a comparative insight on the structural defects between samples. XPS was used to investigate the chemical states of elements in graphene, such as sp2 and sp3 hybridization states of carbon, as well as the chemical effect of functionalization on graphene. High resolution XPS analysis was performed for C 1s, F 1s and N 1s core-levels for all the graphene samples. The XPS results showed the elemental composition and the impurities of each sample. All powders showed less presence of carboxyl groups, compared to their respective suspensions and inks. F-functionalized suspension and inks showed a significant decrease in the at-% of fluorine relative to the powder. These valuable insights, particularly when correlated, allowed the tracking of the structural and chemical changes of graphene along its production process.
T2 - 3rd FUB Nano Colloquium
CY - Berlin, Germany
DA - 15.07.2025
KW - Functionalized graphene
KW - Graphene-related 2D materials (GR2M)
KW - Raman Spectroscopy
KW - XPS
KW - Inks
PY - 2025
AN - OPUS4-64116
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Madbouly, Loay Akmal
A1 - Hodoroaba, Vasile-Dan
A1 - Radnik, Jörg
T1 - Raman Spectroscopy and X-ray Photoelectron Spectroscopy of Commercial Functionalized Graphene
N2 - Graphene has found widespread commercial use, particularly in flexible electronics and coatings for substrates such as paper and textiles, in the form of suspensions and inks (Zhang et al., 2017). Functionalization of graphene allows fine-tuning of properties like electrical conductivity. Structural and chemical features of graphene materials are typically analyzed by Raman spectroscopy and X-ray photoelectron spectroscopy (XPS). While Raman spectroscopy plays a critical role in identifying the presence of graphene and characterizing its structural defects (Pollard et al., 2017), XPS examines the chemistry of graphene. This study investigates three types of graphene materials — graphene (unfunctionalized, G-graphene), fluorine-functionalized graphene (F-graphene), and nitrogen-functionalized graphene (N-graphene) — across three physical forms: powders, suspensions, and embedded in inks. Functionalization was performed via plasma treatment of G-graphene with fluorine or ammonia gases. Suspensions were obtained by dispersing powders in distilled water, while inks were formulated using diacetone alcohol, carbon black, and graphene. Raman spectroscopy analysis confirmed the graphitic nature of all materials and revealed differences in defect density across different forms. The characteristic D, G, and D’ bands varied in relative intensity, offering insight into structural integrity and functionalization effects. XPS measurements examined core-level spectra (C 1s, F 1s, N 1s), revealing chemical bonding environments and hybridization states, including the sp² and sp³ states. A notable decline in fluorine content in F-graphene suspensions and inks, relative to powders, was observed. Existence of organic fluorine and total absence of metallic fluorine were observed. Raman spectroscopy and XPS data provided a correlated view of structural and chemical evolution through the graphene production chain.
T2 - Joint Regulatory Risk Assessors Summit – Advancing Safety & Sustainability Assessments of Advanced Materials
CY - Paris, France
DA - 19.06.2025
KW - Graphene-related 2D materials (GR2M)
KW - Inks
KW - Raman Spectroscopy
KW - XPS
KW - Functionalized graphene
PY - 2025
UR - https://macrame-project.eu/macrame-meetings-workshops/jointrras/#Agenda
AN - OPUS4-63661
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CHAP
A1 - Tamang, S.
A1 - Wegner, Karl David
A1 - Reiss, P.
ED - Alivisatos, P.
ED - Jang, E.
ED - Ma, R.
T1 - Quantum Dot Material Systems, Compositional Families
N2 - Following the discovery of the quantum confinement effect in the early 1980s, it took more than 10 years to be able to synthesize monodisperse colloidal quantum dots (QDs) using organometallic chemistry approaches. The researchers behind these pioneering works, Alexey Ekimov, Louis Brus, and Moungi Bawendi, were awarded the Nobel Prize in Chemistry in 2023, exactly 30 years after the seminal report on the preparation of cadmium chalcogenide QDs. From the synthetic point of view, this approach, relying on the fast injection of a chalcogenide precursor dissolved in a tertiary phosphine into a hot solution of the cadmium precursor in a coordinating solvent (trioctylphosphine oxide, TOPO) acting at the same time as surface ligand, was revolutionary. It enabled the fast synthesis of wellcrystallized CdS, CdSe, and CdTe QDs of low size dispersion and high colloidal stability, whose size and hence optical and electronic properties could be conveniently tuned with the reaction time. Due to the comparable ease of this method and the later developed shelling procedures with ZnS, ZnSe, CdS, and mixtures or alloys of these materials, CdSe has become the workhorse for the entire QD field, covering the whole visible range of absorption and emission.
Meanwhile, several breakthroughs have been achieved, which enabled us to bring QDs to their maturity of today and integrate them in several applications, in particular those relying on their exceptional luminescence properties, such as biological imaging as well as displays and screens. For such real-life applications, the quest for less toxic, safer-to-use, and environmentally friendly materials is of utmost importanceand a highly active research field. The use of cadmium- and lead-based materials is severely restricted by regulations such as the RoHS directive of the European Union: the maximum concentrations of lead and cadmium are 0.1 and 0.01% by weight, respectively, in all homogeneous materials in electrical and electronicequipment. Several families of alternative materials have been explored, with the most important ones for display technologies being indium phosphide (InP)- and ternary chalcopyrite-type QDs.
KW - Quantum dots
KW - Photoluminescence
KW - LED
KW - Display technology
PY - 2025
SN - 978-1-394-18187-2
SP - 23
EP - 62
PB - John Wiley & Sons Ltd.
AN - OPUS4-64675
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Ahmed, A. A. A.
A1 - Alegret, N.
A1 - Almeida, B.
A1 - Alvarez-Puebla, R.
A1 - Andrews, A. M.
A1 - Ballerini, L.
A1 - Barrios-Capuchino, J. J.
A1 - Becker, C.
A1 - Blick, R. H.
A1 - Bonakdar, S.
A1 - Chakraborty, I.
A1 - Chen, X.
A1 - Cheon, J.
A1 - Chilla, G.
A1 - Conceicao, A. L. C.
A1 - Delehanty, J.
A1 - Dulle, M.
A1 - Efros, A. L.
A1 - Epple, M.
A1 - Fedyk, M.
A1 - Feliu, N.
A1 - Feng, M.
A1 - Fernandez-Chacon, R.
A1 - Fernandez-Cuesta, I.
A1 - Fertig, N.
A1 - Förster, S.
A1 - Garrido, J. A.
A1 - George, M.
A1 - Guse, A. H.
A1 - Hampp, N.
A1 - Harberts, J.
A1 - Han, J.
A1 - Heekeren, H. R.
A1 - Hofmann, U. G.
A1 - Holzapfel, M.
A1 - Hosseinkazemi, H.
A1 - Huang, Y.
A1 - Huber, P.
A1 - Hyeon, T.
A1 - Ingebrandt, S.
A1 - Ienca, M.
A1 - Iske, A.
A1 - Kang, Y.
A1 - Kasieczka, G.
A1 - Kim, D.-H.
A1 - Kostarelos, K.
A1 - Lee, J.-H.
A1 - Lin, K.-W.
A1 - Liu, S.
A1 - Liu, X.
A1 - Liu, Y.
A1 - Lohr, C.
A1 - Mailänder, V.
A1 - Maffongelli, L.
A1 - Megahed, S.
A1 - Mews, A.
A1 - Mutas, M.
A1 - Nack, L.
A1 - Nakatsuka, N.
A1 - Oertner, T. G.
A1 - Offenhäusser, A.
A1 - Oheim, M.
A1 - Otange, B.
A1 - Otto, F.
A1 - Patrono, E.
A1 - Peng, B.
A1 - Picchiotti, A.
A1 - Pierini, F.
A1 - Pötter-Nerger, M.
A1 - Pozzi, M.
A1 - Pralle, A.
A1 - Prato, M.
A1 - Qi, B.
A1 - Ramos-Cabrer, P.
A1 - Resch-Genger, Ute
A1 - Ritter, N.
A1 - Rittner, M.
A1 - Roy, S.
A1 - Santoro, F.
A1 - Schuck, N. W.
A1 - Schulz, F.
A1 - Seker, E.
A1 - Skiba, M.
A1 - Sosniok, M.
A1 - Stephan, H.
A1 - Wang, R.
A1 - Wang, T.
A1 - Wegner, Karl David
A1 - Weiss, P. S.
A1 - Xu, M.
A1 - Yang, C.
A1 - Zargarin, S. S.
A1 - Zeng, Y.
A1 - Zhou, Y.
A1 - Zhu, D.
A1 - Zierold, R.
A1 - Parak, W. J.
T1 - Interfacing with the Brain: How Nanotechnology Can Contribute
N2 - Interfacing artificial devices with the human brain is the central goal of neurotechnology. Yet, our imaginations are often limited by currently available paradigms and technologies. Suggestions for brain−machine interfaces have changed over time, along with the available technology.
Mechanical levers and cable winches were used to move parts of the brain during the mechanical age. Sophisticated electronic wiring and remote control have arisen during the electronic age, ultimately leading to plug-and-play computer interfaces. Nonetheless, our brains are so complex that these visions, until recently, largely remained unreachable dreams. The general problem, thus far, is that most of our technology is mechanically and/or electrically engineered, whereas the brain is a living, dynamic entity. As a result, these worlds are difficult to interface with one another. Nanotechnology, which encompasses engineered solid-state objects and integrated circuits, excels at small length scales of single to a few hundred nanometers and, thus, matches the sizes of biomolecules, biomolecular assemblies, and parts of cells. Consequently, we envision nanomaterials and nanotools as opportunities to interface with the brain in alternative ways. Here, we review the existing literature on the use of nanotechnology in brain−machine interfaces and look forward in discussing perspectives and limitations based on the authors’ expertise across a range of complementary disciplines from neuroscience, engineering, physics, and chemistry to biology and medicine, computer science and mathematics, and social science and jurisprudence. We focus on nanotechnology but also include information from related fields when useful and complementary.
KW - Nanoneuro interface
KW - Brain-on-a-chip
KW - Nanostructured interface
KW - Electrode arrays
KW - Neuro-implants
KW - Advanced nanomaterials
KW - Quality assurance
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-634893
DO - https://doi.org/10.1021/acsnano.4c10525
SN - 1936-086X
VL - 19
IS - 11
SP - 10630
EP - 10717
PB - ACS Publications
AN - OPUS4-63489
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - El-Dahshan, O.
A1 - Deniaud, A.
A1 - Ling, W. L.
A1 - Wegner, Karl David
A1 - Proux, O.
A1 - Veronesi, G.
A1 - Reiss, P.
T1 - Hydrothermal microwave synthesis of water soluble NIR-II emitting Ag2S quantum dots
N2 - Hydrothermal-based synthetic methods of quantum dots allow for the exploration of reaction parameters normally inaccessible to typical aqueous-based batch reactions, such as elevated reaction temperatures (>100 °C) and reaction pressures above atmospheric pressure. Coupled with microwave heating, new instantaneously bio-compatible quantum dots (QDs) with enhanced opitcal properties can be yielded. As of today, aqueous-based synthetic methods often lag behind their organic analogues in terms of the photophysical properties of the QDs obtained and the ease of modulation of both the emission wavelength and crystallite size. Using a novel microwave-assisted hydrothermal approach, the synthesis of silver sulphide (Ag2S) QDs exhibiting NIR emission spanning the biological transparency windows via modulation of the reaction parameters has been developed. The intrinsic link between their optical and structural properties is explored via laboratory and synchrotron-based structural analysis techniques. Their toxicity towards a hepatic cell line was assessed, and related back to their structure and size. Overall this work aims to not only further develop the repertoire of synthetic methods for the synthesis of Ag2S QDs, but also paves the way for the development of safer QDs suitable for future clinical applications.
KW - Quantum dots
KW - Microwave synthesis
KW - Quality assurance
KW - NIR-II emission
KW - PL quantum yield
KW - Ag2S
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-634825
DO - https://doi.org/10.1039/d5nr00052a
SN - 2040-3372
VL - 17
IS - 24
SP - 14637
EP - 14646
PB - RSC
AN - OPUS4-63482
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Nakadi, Flavio V.
T1 - Single-event analysis of discrete entities using microwave-induced nitrogen plasma–mass spectrometry
N2 - ICP-MS has become a standard for (ultra)trace elemental analysis due to its excellent sensitivity and multi-element capabilities. However, its widespread use is hampered by spectral interferences—especially in the low mass range (<81 amu)—primarily arising from Ar-based polyatomic ions, such as ArO+ and Ar2+, which compromise the accurate quantification of key elements like Fe and Se.1 Over the years, improvements such as collision/reaction cells and sector-field configurations have
helped mitigate these interferences, albeit often at the cost of instrument complexity and increased operational burden.The microwave-induced nitrogen plasma (MINP) source, sustained by microwaves at atmospheric pressure and using nitrogen as the plasma gas, offers a fundamentally different plasma environment. Nitrogen is not only more economical (40-60%) and readily available than Ar, but also avoids the generation of problematic Ar-based interferences. While MINP had been previously applied in optical emission and bulk mass spectrometry,2 its implementation in single-event detection had not yet been demonstrated.
This study pioneers the application of MINP-MS in single-event mode for real-time, high-throughput characterization of NPs, cells, and MPs. The evaluation began with Fe2O3 NPs monitoring the 56Fe nuclide, with a limit of detection of 8.6 ag for Fe, equivalent to a particle size threshold of 19 nm—surpassing the detection capabilities of quadrupole-based ICP-MS systems. Size distribution results
obtained by SP-MINP-MS for Fe2O3 NPs (20–70 nm) matched closely with transmission electron microscopy (TEM) and dynamic light scattering (DLS), confirming the method’s accuracy.
For Se, despite its high ionization energy, metallic SeNPs (150 and 250 nm) were reliably quantified by monitoring 80Se. A calibration curve constructed using SeNP standards yielded excellent linearity (R2 = 0.9994). This approach was further extended to single-cell analysis, using Se-enriched yeast (SELM-1 CRM) as a model. A transport efficiency-independent calibration strategy was employed, relying on SeNPs to determine Se content per cell. The results showed strong agreement with data from conventional SC-ICP-MS, with average Se masses of ~65 fg per cell, validating the
performance of SC-MINP-MS for biological systems. Additionally, the instrument's capability to handle large, low atomic number particles was demonstrated via the analysis of polystyrene (PS) and polytetrafluoroethylene (PTFE) MPs. These MPs (2.5–3.0 µm) were quantified by monitoring 12C+ signals and applying a calibration strategy using citric acid as a standard. The resulting size distributions closely matched nominal sizes, reinforcing the system’s robustness for micrometer-sized polymeric materials. Event durations ranging from 470 to over 900 µs were consistent with literature values for single-entity ICP-MS and correlated well with particle size.
These findings establish single-event MINP-MS as a promising analytical platform for analyzing discrete entities. It provides significant advantages over conventional Ar-based ICP-MS, including reduced interferences, lower operational cost, and comparable or superior sensitivity for analytes such as Fe and Se. By avoiding the limitations of Ar-based plasmas and enabling accurate quantification across a wide range of particle types and sizes, MINP-MS in single-event mode opens new avenues for high-resolution, interference-free elemental analysis at the individual entity level.
T2 - 17th Rio Symposium on Atomic Spectrometry (17th RSAS)
CY - São Pedro City, Brazil
DA - 09.11.2025
KW - MICAP-MS
KW - Nitrogen plasma
KW - Nanoparticles
KW - Cells
KW - Microplastic
KW - Single particle
KW - Single event
KW - ICP-MS
PY - 2025
AN - OPUS4-64954
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Schilling, Markus
T1 - Semantic Technologies in Action: Integrating Mechanical and Microstructure Data in MSE
N2 - Semantic technologies (ST) are a powerful tool for storing, processing, and querying data in a contextualized and interoperable manner. They enable machine-actionable and human-readable knowledge representations essential for advanced data management, retrieval, and reuse. As one of the key factors within the frame of the collaborative project platform MaterialDigital (PMD), the establishment of a virtual material data space and the semantic modeling of hierarchical, process-dependent material data is aimed at to serve as best-practice examples of knowledge representation through ontologies and knowledge graphs.
In this presentation, the application of ST to a specific use case from the field of materials sciences and engineering (MSE) is demonstrated: the integration and analysis of data related to a 2000 series age-hardenable aluminum alloy. By semantically representing mechanical and microstructural data obtained from tensile tests and dark-field transmission electron microscopy across various aging times, an expandable knowledge graph was constructed that is aligned with the PMD Core Ontology (PMDco) and enriched through the Tensile Test (TTO) and Precipitate Geometry Ontologies. This semantically integrated dataset enables advanced analytical capabilities via SPARQL queries and reveals microstructure–property relationships consistent with the well-known Orowan mechanism. The approach highlights the potential of semantic data integration to support FAIR data principles and to foster a more data-centric and interoperable research infrastructure in MSE.
T2 - MSE Research Data Forum 2025
CY - Siegburg, Germany
DA - 08.07.2025
KW - Semantic Data
KW - Data Integration
KW - Digitalization
KW - Data Interoperability
PY - 2025
AN - OPUS4-63666
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Scholtz, Lena
T1 - Luminescent, Semiconductor Nanoparticle-Loadedpolymer Microbeads–Comparingparticlearchitectures
N2 - Luminescent polymer microparticles (PMPs) are applied in various (bio)analytical and diagnostic processes.[1] The staining of these beads is important for the realization of optically distinguishable barcodes that can be read out, e.g., by a flow cytometer or fluorescence microscope. Typically, luminescent semiconductor nanoparticles (NPs) absorb in a broad wavelength range and show narrow emission bands, which enables simultaneous excitation of differently colored luminophores and facilitates a spectral discrimination.[1] This makes them ideal candidates for this purpose and encouraged us to explore and develop a simple, effective approach to luminescent semiconductor NP encoding of polystyrene PMPs and identify suitable synthesis conditions.[2]
Until now, mainly semiconductor quantum dots (QDs) have been used for the synthesis of luminescent PMPs, although NPs with different shapes could introduce beneficial new features. Aiming for the application of our developed procedure to non-spherical NPs, we systematically investigated the luminescence properties of the resulting NP-stained beads using fluorescence and integrating sphere spectroscopy as well as fluorescence and electron microscopy. These studies showed that the suitability of semiconductor NPs for the synthesis of luminescent PMPs depends not only on their shape, but also heavily on their surface chemistry.[3] The successful incorporation of nonspherical NPs opens the path to include even more NPs, and the results can help to deduce future applications for the beads which best suit their specific properties.
T2 - E-MRS Fall Meeting 2025
CY - Warsaw, Poland
DA - 15.09.2025
KW - Quality assurance
KW - Fluorescence
KW - Nano
KW - Particle
KW - Synthesis
KW - Quantum dot
KW - Quantum rod
KW - Platelet
KW - Quantum yield
KW - Polymer particle
KW - Encoding
KW - Surface chemistry
KW - Mechanism
KW - Characterization
KW - Lifetime
KW - Barcode
KW - Polymerization
KW - Method
PY - 2025
AN - OPUS4-64242
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Wegner, Karl David
T1 - Ag₂S nanocrystals as next-generation, heavy-metal free SWIR emitter for biomedical imaging and sensing applications
N2 - There is a growing interest in the exploitation of the short-wave infrared (SWIR), which refers to the wavelength band of light between 900 nm and 2500 nm. Luminophores that emit in the SWIR are used in various areas of telecommunications, photovoltaics, security systems (night vision), and in biomedicine. In particular for biomedical applications, the SWIR range is highly promising because light scattering, absorption, and autofluorescence of tissue and biological compounds are strongly reduced compared to the visible (400–700 nm) and NIR (~700–900 nm). The benefits of SWIR-emissive QDs have been demonstrated for a variety of applications, such as in thermal sensing, as photoelectrochemical biosensor, in in vivo vascular imaging, and for fluorescence-guided surgery.
Full exploitation of SWIR photoluminescence (PL) imaging and sensing is currently hampered by i.) a lack of suitable advanced nanomaterials with a high PL quantum yield (PL QY) and a high brightness, that can be used safely in vivo and ii.) a lack of quantitative and reliable data on the optical properties of many SWIR emitters. Promising nanomaterials for the SWIR are heavy metal-free Ag2S quantum dots (QDs).
Aiming for the development of SWIR advanced nanomaterials with optimum performance, we have dived deeper into the photophysical processes occurring in these nanomaterials, thereby exploring in depth how the environment such as temperature, surface ligand composition, and the incorporation of transition metals influence the optical properties Ag2S QDs. We observed a strong enhancement of the SWIR emission of upon addition of metal ions such as Zn2+, yielding PL quantum yields of about 10% and thus making them highly suitable for non-invasive deep imaging of vascular networks and 3D fluid flow mapping.
T2 - Shining a light on biomedical and energy applications (Shift)
CY - Tenerife, Spain
DA - 13.10.2025
KW - Quantum dots
KW - Short-wave infrared
KW - SWIR
KW - Spectroscopy
KW - Photoluminescence
KW - Quantum yield
PY - 2025
AN - OPUS4-64673
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Ruehle, Bastian
T1 - A Self-Driving Lab for Nano and Advanced Materials Synthesis
N2 - Nano- and advanced materials have been recognized as a key enabling technology of the 21st century, due to their high potential of driving innovations in new clean energy technologies, sustainable manufacturing by substitution of critical raw materials and replacement of hazardous substances, breakthroughs in energy conversion and storage, improvement of the environmental performance of products and processes, and facilitation of circularity. Consequently, new tools that enhance the development and optimization cycle of nano- and advanced materials are crucial.
In this contribution, we present our Self-Driving Lab (SDL) for Nano and Advanced Materials [1], that integrates robotics for batched autonomous synthesis – from molecular precursors to fully purified nanomaterials – with automated characterization and data analysis, for a complete and reliable nanomaterial synthesis workflow. By fully automating the processing steps for seven different materials from five representative, completely different classes of nano- and advanced materials (metal, metal oxide, silica, metal organic framework, and core–shell particles) that follow different reaction mechanisms, we demonstrate the great versatility and flexibility of the platform. The system also exhibits high modularity and adaptability in terms of reaction scales and incorporates in-line characterization measurement of hydrodynamic diameter, zeta potential, and optical properties (absorbance, fluorescence). We discuss the excellent reproducibility of the various materials synthesized on the platform in terms of particle size and size distribution, and the adaptability and modularity that allows access to a diverse set of nanomaterial classes.
We also present several key aspects of the central backend that orchestrates the (parallelized) syntheses workflows. One key feature is the resource management or “traffic control” for scheduling and executing parallel reactions in a multi-threaded environment. Another is the interface with data analysis algorithms from in-line, at-line, and off-line measurements. Here, we will give examples of how automatic image segmentation of electron microscopy images with the help of AI [2] can be used for reducing the “data analysis bottleneck” from an off-line measurement. We will also discuss various machine learning (ML) algorithms that are currently implemented in the backend and can be used for ML-guided, closed-loop material optimization in our SDL. Lastly, we will show our recent efforts [3] in making the workflow generation on SDLs more user-friendly by using large language models to generate executable workflows automatically from synthesis procedures given in natural language and user-friendly graphical user interfaces based on node editors that also allow for knowledge graph extraction from the workflows. In this context, we are currently also working on a common description or ontology for representing the process steps and parameters of the workflows, which will greatly facilitate the semantic description and interoperability of workflows between different SDL hardware and software platforms.
These features underscore the SDL’s potential as a transformative tool for advancing and accelerating the development of nano- and advanced materials, offering solutions for a sustainable and environmentally responsible future.
T2 - MRS Fall Meeting 2025
CY - Boston, MA, USA
DA - 30.11.2025
KW - Self-Driving Labs
KW - Materials Acceleration Platforms
KW - Advanced Materials
KW - Nanomaterials
KW - Automation
PY - 2025
AN - OPUS4-65129
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - GEN
A1 - Habibimarkani, Heydar
A1 - Prinz, Carsten
A1 - Sahre, Mario
A1 - Hodoroaba, Vasile-Dan
A1 - Radnik, Jörg
T1 - CV, TEM, XRD and XPS/HAXPES datasets of FeNi-based nanoparticles for the oxygen evolution reaction
N2 - The datasets from Cyclic Voltammetry, Transmision Electron Microscopy, X-ray Diffraction, and (Hard Energy) X-ray Photoelectron Spectroscopy are related to the publication
H. Habibimarkani, S.-L. Abram, A. Guilherme Buzanich, C. Prinz, M. Sahre, V.-D. Hodoroaba and J. Radnik
"In-depth analysis of FeNi-based nanoparticles for the oxygen evolution reaction"
Scientific Reports (2025), https://doi.org/10.1038/s41598-025-92720-3
Details of the materials and the experimental procedures are described in this publications.
KW - Oxygen evolution reaction
KW - Fe-Ni nanopartices
KW - Comprehensive analysis
PY - 2025
DO - https://doi.org/10.5281/zenodo.14975964
PB - Zenodo
CY - Geneva
AN - OPUS4-63335
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Madbouly, Loay Akmal
T1 - Chemical analysis of commercial functionalized graphene along the production process
N2 - Graphene has found widespread commercial use, particularly in flexible electronics and coatings for substrates such as paper and textiles, in the form of suspensions and inks (Zhang et al., 2017). Functionalization of graphene allows fine-tuning of properties like electrical conductivity. Structural and chemical features of graphene materials are typically analyzed by Raman spectroscopy and X-ray photoelectron spectroscopy (XPS). While Raman spectroscopy plays a critical role in identifying the presence of graphene and characterizing its structural defects (Pollard et al., 2017), XPS examines the chemistry of graphene. This study investigates three types of graphene materials — graphene (unfunctionalized, G-graphene), fluorine-functionalized graphene (F-graphene), and nitrogen-functionalized graphene (N-graphene) — across three physical forms: powders, suspensions, and embedded in inks. Functionalization was performed via plasma treatment of G-graphene with fluorine or ammonia gases. Suspensions were obtained by dispersing powders in distilled water, while inks were formulated using diacetone alcohol, carbon black, and graphene. Raman spectroscopy analysis confirmed the graphitic nature of all materials and revealed differences in defect density across different forms. The characteristic D, G, and D’ bands varied in relative intensity, offering insight into structural integrity and functionalization effects. XPS measurements examined core-level spectra (C 1s, F 1s, N 1s), revealing chemical bonding environments and hybridization states, including the sp² and sp³ states. A notable decline in fluorine content in F-graphene suspensions and inks, relative to powders, was observed. Existence of organic fluorine and total absence of metallic fluorine were observed. Raman spectroscopy and XPS data provided a correlated view of structural and chemical evolution through the graphene production chain (Figure 1).
T2 - RamanFest 2025
CY - Frankfurt, Germany
DA - 02.07.2025
KW - Functionalized graphene
KW - Graphene-related 2D materials (GR2M)
KW - Raman Spectroscopy
KW - XPS
KW - Inks
PY - 2025
AN - OPUS4-64114
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Madbouly, Loay Akmal
T1 - Raman Spectroscopy and X-ray Photoelectron Spectroscopy of Commercial Functionalized Graphene
N2 - Graphene has been commercialized for over a decade. For many applications like flexible electronics, coating of different materials like paper or for textiles, it used in the form of suspensions or inks [1]. Graphene powders are typically used as the starting material for the synthesize of graphene suspensions and graphene inks. Functionalization enables tailoring the properties of graphene, such as the sheet resistance. X-ray photoelectron spectroscopy (XPS), Raman spectroscopy, along other techniques are used to characterize graphene flakes, functionalized and otherwise. Raman spectroscopy is necessary as a primary step to validate the existence of graphene structure in graphene powders [2]. XPS is commonly used to investigate the elemental composition, including impurities, and the chemical structure of graphene.
In this study, we investigate the following set of commercial materials: fluorine-functionalized graphene (F-graphene) and nitrogen-functionalized graphene (N-graphene) as well as unfunctionalized graphene (G-graphene) in the forms of powders, suspensions, and inks. The functionalization process for the graphene powder was carried out in a plasma reactor by purging fluorine and ammonia gases, in separate processes, over the G-graphene powder. The suspensions were prepared by adding distilled water to the powders. The inks consist of diacetone alcohol, carbon black, and graphene powders.
Raman spectroscopy and XPS are complementary techniques. Our results obtained from Raman spectroscopy confirmed the existence of graphene structures in all samples and provided a comparative insight on the structural defects between samples. XPS was used to investigate the chemical states of elements in graphene, such as sp2 and sp3 hybridization states of carbon, as well as the chemical effect of functionalization on graphene. High resolution XPS analysis was performed for C 1s, F 1s and N 1s core-levels for all the graphene samples: G-graphene, F-graphene, and N-graphene, in all forms. The XPS results showed the elemental composition and the impurities of each sample. All powders showed less presence of carboxyl groups, compared to their respective suspensions and inks. F-functionalized suspension and inks showed a significant decrease in the at% of fluorine relative to the powder. These valuable insights, independent and when correlated, allowed the tracking of the structural and chemical changes of graphene along its production process.
T2 - E-MRS 2025
CY - Strasbough, France
DA - 26.05.2025
KW - Functionalized graphene inks
PY - 2025
AN - OPUS4-64113
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Habibimarkani, Heydar
A1 - Abram, Sarah-Luise
A1 - de Oliveira Guilherme Buzanich, Ana
A1 - Prinz, Carsten
A1 - Sahre, Mario
A1 - Hodoroaba, Vasile-Dan
A1 - Radnik, Jörg
T1 - In-depth analysis of FeNi-based nanoparticles for the oxygen evolution reaction
N2 - This study investigates the effect of varying iron-to-nickel ratios on the catalytic performance of Fe-Ni oxide nanoparticles (NPs) for the oxygen evolution reaction (OER). Addressing the issue of high energy wastage due to large overpotentials in OER, we synthesized and characterized different NP catalysts with different Fe: Ni oxide ratios. Transmission Electron Microscopy (TEM), Energy Dispersive X-ray Spectroscopy (EDS), and X-ray Diffraction (XRD) were employed to determine the morphology, elemental and phase composition of the NPs. Furthermore, in-depth profiling with X-ray Photoelectron Spectroscopy (XPS) and Hard X-ray Photoelectron Spectroscopy (HAXPES) revealed that iron predominantly exists as oxide, while nickel exhibits both metallic and oxidic forms depending on the Fe content. XPS indicated an enrichment of iron at the NP surface, whereas HAXPES and EDS data agreed on the bulk stoichiometry. The assessment of the catalytic activity via cyclic voltammetry (CV) showed that the Fe: Ni ratio of 2:3 exhibited superior performance, characterized by lower overpotential and a smaller Tafel slope.
KW - Fe-Ni oxide
KW - Nanoparticles
KW - OER
KW - Catalytic performance
KW - Cyclic voltammetry
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-626932
UR - https://www.nature.com/articles/s41598-025-92720-3
DO - https://doi.org/10.1038/s41598-025-92720-3
VL - 15
IS - 1
SP - 1
EP - 17
PB - Springer Nature
AN - OPUS4-62693
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Pauw, Brian Richard
T1 - Holistic Experimentation in the HExX-Lab
N2 - Through bottom-up, comprehensive digitalisation of all aspects of an experiment, the HEX-lab improves the trustworthiness (traceability, reproducibility, quality) of scientific findings.
The five main parts that make up a materials science experiment, i.e. Sample preparation, Measurements, Processing, Analysis, and Interpretation, each have been addressed in thorough and unique ways in this lab, building up a foundation for a wide range of materials science collaborations. Improvements span the spectrum.
Hardware developments include new sample environments and stages, such as grazing incidence motion towers, electrochemistry cells and flow-through holders, electronic components such as safety interlocks and multipurpose I/O controllers, and liquid handling systems such as coolant flow cross-over systems.
Software developments include:
1) a new comprehensive control system operating on both the RoWaN as well as the MOUSE allowing for full Python control and sequencing of all experimentation,
2) Automated scripts for instrument optimization, sample alignments and measurements,
3) revamped data pipelines and analysis software, standalone or launched as part of operations sequencing dashboards on servers, and
4) meticulously structured archival datafiles, fully documenting sample preparation, measurements, processing and analyses. These allow for holistic databases and dashboards to be constructed to investigate the links between synthesis parameters and resulting morphology.
This poster will highlight some of the tools and techniques developed and available in the HEX-lab over the years, from sample environments to overarching experiment and data organisation structures.
T2 - Materials Science Core Facility Synergy Forum 2025
CY - Bremen, Germany
DA - 26.02.2025
KW - Digitalization
KW - Holistic experiments
KW - Traceability
KW - Data provenance
PY - 2025
AN - OPUS4-62675
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Madbouly, Loay Akmal
A1 - Sturm, Heinz
A1 - Doolin, Alexander
A1 - Hodoroaba, Vasile-Dan
A1 - Radnik, Jörg
T1 - Chemical Analysis of Commercial Functionalized Graphene Nanoplatelets along the Production Process with Raman Spectroscopy and X-ray Photoelectron Spectroscopy
N2 - Commercial applications increasingly rely on functionalized graphene nanoplatelets (GNPs) supplied as powders, aqueous suspensions, and printable inks, yet their process−structure−property relationships across the production chain remain to be fully mapped. Here we apply a correlative Raman spectroscopy (Raman) and X-ray photoelectron spectroscopy (XPS) workflow to nine independent industrial graphene batches spanning three surface chemistries, raw (R), fluorinated (F), and nitrogen-functionalized (N), in all three physical forms which are powders, suspensions, and inks.
Raman mapping (with a 532 nm excitation laser) showed that I2D/IG is highest for N samples and lowest for R-ink. A 2D-vs-G correlation places all samples on a trajectory parallel to the pure-doping vector, which can correlate to holes in the graphene lattice. The mean point-defect spacing is LD = 8.4−10.0 nm. High-resolution XPS resolves the accompanying chemical changes: F-powder exhibits distinct C−F (289 eV), C−F2 (292 eV), and C−F3 (293 eV) components and loses roughly half its F content upon dispersion in deionized water or ink formulation; inks of all chemistries show a pronounced O−C=O peak near 289−290 eV originated from the ink compounds. N-functionalized samples showed a prominent C−N (285.5 eV) only for the ink formulated N-functionalized sample. This study establishes a process-aware blueprint linking the functionalization route and formulation step to lattice disorder and surface chemistry, offering transferable quality-control metrics for graphene supply chains in industrial products/applications such as coatings, storage devices, and printed electronics.
KW - Functionalized graphene
KW - Raman Spectroscopy
KW - XPS
KW - Chemical analysis
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-652548
DO - https://doi.org/10.1021/acs.jpcc.5c06820
SN - 1932-7447
VL - 129
IS - 50
SP - 22033
EP - 22040
PB - American Chemical Society (ACS)
AN - OPUS4-65254
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Nicolai, Marcel
T1 - Investigation of lamb wave mode repulsion with a spring-based model
N2 - Lamb waves are widely utilized in material characterization, non-destructive testing (NDT), and structural health monitoring (SHM). A unique feature of Lamb waves is mode repulsion, where dispersion curves approach each other but do not cross. This phenomenon is observed in both single and multilayer plates and is influenced by wave coupling. While mode repulsion in single plates has been linked to symmetry-breaking effects, its underlying mechanism in multilayer systems remains unclear. This study investigates mode repulsion in a coupled aluminum-polycarbonate plate system using a spring-based interface model. Dispersion curves are computed via the Scaled Boundary Finite Element Method, and time-domain simulations are used to analyze the interface dynamics. Results indicate that repulsion depends on interface stiffness, distinguishing between opening and closing repulsion regions. The study further reveals that mode repulsion corresponds to distinct oscillatory behaviors in the interface, where certain wave modes induce increased coupling spring elongation, leading to localized strain. A coupled harmonic oscillator model effectively explains opening repulsion regions but does not fully capture closing regions. Findings suggest that mode repulsion could be leveraged for non-destructive evaluation of adhesive interfaces, offering insights into bond strength characterization. This research contributes to a deeper understanding of wave interactions in multilayer structures and provides a theoretical foundation for advancing NDT and SHM techniques.
T2 - 2025 ICU PADERBORN - 9th International Congress on Ultrasonics
CY - Paderborn, Germany
DA - 21.09.2025
KW - Lamb waves
KW - Mode repulsion
KW - Coupled plates
KW - Elastic interface
KW - Dispersion curves
PY - 2025
AN - OPUS4-65531
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Chahal, Shweta
T1 - Sustainable Synthesis of Na+ and Bi3+ - doped Cs₂AgInCl₆ Double Perovskites for Efficient White-Light Emission
N2 - Double halide perovskites have emerged as promising, less-toxic alternatives to lead-based perovskites for diverse photochemical applications. Among them, Cs₂AgInCl₆ has attracted significant attention, particularly when doped with various elements, which induce self-trapped exciton (STE) states within the bandgap, resulting in efficient white-light emission and a remarkable enhancement of photoluminescence quantum yield (PL QY). While several solid-state and solution-based methods have been employed for the synthesis of double halide perovskites, many rely on toxic solvents and complex procedures, hindering scalability. In this study, we present two environmentally friendly synthesis approaches for the preparation of Cs₂AgInCl₆ doped with monovalent (Na⁺) and trivalent (Bi³⁺) cations:
1. Green solution-based method: Utilizes mild reagents and entirely replaces harsh chemicals, enabling synthesis at ambient conditions.
2. Mechanochemical approach: Employs high-energy ball milling for 62 minutes at room temperature to obtain the desired crystalline phase.
These green methodologies provide sustainable and scalable alternatives to conventional routes, minimizing the environmental footprint. We systematically compare the structural and optical properties of the doped perovskites synthesized via both approaches. The resulting materials exhibit strong UV absorption, broadband white-light emission, high PL QY (up to 85%, Fig. 1), long PL lifetimes, and good thermal and environmental stability (up to 300 °C in air). These results highlight the potential of doped Cs₂AgInCl₆ double perovskites as an eco-friendly material with possible photonic applications as in white-light devices.
T2 - eMRS Fall Meeting 2025
CY - Warsaw, Poland
DA - 15.09.2025
KW - Fluorescence
KW - Advanced material
KW - Perovskite
KW - Synthesis
KW - Characterization
KW - Fluorescence quantum yield
KW - Absolute
KW - Integrating sphere spectroscopy
KW - Sustainable synthesis
KW - Lifetime
KW - Photophysics
PY - 2025
AN - OPUS4-64185
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Zaki, Mohammad
A1 - Prinz, Carsten
A1 - Ruehle, Bastian
T1 - A Self-Driving Lab for Nano- and Advanced Materials Synthesis
N2 - The recent emergence of self-driving laboratories (SDL) and material acceleration platforms (MAPs) demonstrates the ability of these systems to change the way chemistry and material syntheses will be performed in the future. Especially in conjunction with nano- and advanced materials which are generally recognized for their great potential in solving current material science challenges, such systems can make disrupting contributions. Here, we describe in detail MINERVA, an SDL specifically built and designed for the synthesis, purification, and in line characterization of nano- and advanced materials. By fully automating these three process steps for seven different materials from five representative, completely different classes of nano- and advanced materials (metal, metal oxide, silica, metal organic framework, and core–shell particles) that follow different reaction mechanisms, we demonstrate the great versatility and flexibility of the platform. We further study the reproducibility and particle size distributions of these seven representative materials in depth and show the excellent performance of the platform when synthesizing these material classes. Lastly, we discuss the design considerations as well as the hardware and software components that went into building the platform and make all of the components publicly available.
KW - Self-driving laboratories
KW - Materials acceleration platforms
KW - Nanomaterials
KW - Advanced materials
KW - Automation
KW - Robotics
KW - In-line characterization
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-627361
DO - https://doi.org/10.1021/acsnano.4c17504
SN - 1936-086X
VL - 19
IS - 9
SP - 9029
EP - 9041
PB - ACS Publications
CY - Washington, DC
AN - OPUS4-62736
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Kossatz, Philipp
A1 - Mezhov, Alexander
A1 - Andresen, Elina
A1 - Prinz, Carsten
A1 - Schmidt, Wolfram
A1 - Resch-Genger, Ute
T1 - Assessing the Applicability of Lanthanide-Based Upconverting Nanoparticles for Optically Monitoring Cement Hydration and Tagging Building Materials
N2 - Chemically stable, lanthanide-based photon upconversion micro- and nanoparticles (UCNPs) with their characteristic multicolor emission bands in the ultraviolet (UV), visible (vis), near-infrared (NIR), and short-wave infrared (SWIR) arepromising optical reporters and barcoding tags. To assess the applicability of UCNPs for the monitoring of early stage cement hydration processes and as authentication tags for cementitious materials, we screened the evolution of the luminescence of Selfmade core-only NaYF4:Yb,Er UCNPs and commercial μm-sized Y2O2S:Yb,Er particles during the first stages of cement hydration, which largely determines the future properties of the hardened material. Parameters explored from the UCNP side included particle size, morphology, surface chemistry or coating, luminescence properties, and concentration in different cement mixtures. From the cement side, the influence of the mineral composition of the cement matrix was representatively examined for ordinary Portland cement (OPC) and its constituents tricalcium aluminate (C3A), tricalcium silicate (C3S), and gypsum at different water to cement ratios. Based on reflection and luminescence measurements, enabling online monitoring, which were complemented by XRD and isothermal heat-flow calorimetric measurements to determine whether the incorporation of these particles could impair cement hydration processes, well suited lanthanide particle reporters could be identified as well as application conditions. In addition, thereby the reporter influence on cement hydration kinetics could be minimized while still preserving a high level of information content. The best performance for the luminescence probing of changes during early stage cement hydration processes was observed for 25 nm-sized oleate (OA)-coated UCNPs added in a concentration of 0.1 wt %. Higher UCNP amounts of 1.0 wt % delayed cement hydration processes size- and surface coatingspecifically in the first 24 h. Subsequent luminescence stability screening studies performed over a period of about one year support the applicability of UCNPs as optical authentication tags for construction materials.
KW - Quality assurance
KW - Fluorescence
KW - Nano
KW - Particle
KW - Synthesis
KW - Quantum yield
KW - NIR
KW - Mechanism
KW - Characterization
KW - XRD
KW - Calorimetry
KW - Advanced material
KW - Cement
KW - Monitoring
KW - Surface
KW - Size
KW - Lifetime
KW - Barcode
KW - Lanthanide
KW - Upconversion
KW - Encoding
KW - Method
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-638318
DO - https://doi.org/10.1021/acsomega.5c02236
SN - 2470-1343
VL - 10
IS - 29
SP - 31587
EP - 31599
PB - ACS Publications
CY - Washington, DC
AN - OPUS4-63831
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - de Oliveira Guilherme Buzanich, Ana
T1 - Bridging Structure and Electronic State: Real-time XES–XRD Fusion for Functional Alloys
N2 - We present a unified X-ray Emission Spectroscopy (XES) and X-ray Diffraction (XRD) approach for real-time, in situ characterization of materials, demonstrated on Co₂FeSi Heusler alloys under varied heat treatments. The combination of XES and XRD is particularly well-suited to Heusler alloys, where subtle changes in atomic ordering and electronic structure (e.g. site occupancy, hybridization, and spin state) are tightly interdependent and critical for their magnetic and transport properties. In addition, this method enables more efficient materials design by reducing experimental iterations through comprehensive structural and electronic analysis. Developed at the mySpot beamline at BESSY-II, the platform integrates (a) digital twin-based experiment planning, (b) open-source XES spectral simulations, (c) an optimized single-shot, two-element XES setup with sub-pixel resolution for enhanced energy precision, and (d) result-driven beamtime utilization. With an unprecedented synchronized XES-XRD platform, we aim to shed light on how diffusion-controlled processes in Heusler alloys and double perovskites at elevated temperatures establish the formation of specific phases with distinct structure types in real time. This, in turn, strongly impacts the functional properties of the materials under scrutiny.
T2 - XLIV Colloquium Spectroscopicum Internationale
CY - Ulm, Germany
DA - 27.07.2025
KW - Multimodal
KW - X-ray spectroscopy
KW - X-ray diffraction
KW - Functional alloys
PY - 2025
AN - OPUS4-63991
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - Bernardino, Carolina
T1 - Effortless Antimicrobial Shield: Spray-coated Silica Nanoparticles For Safer High-touch Surfaces
N2 - Functional films with tailored interfacial properties play a pivotal role for the development of next generation surface coatings, particularly in healthcare-related environments. In this contribution, we present a facile spray-coating method for the creation of antimicrobial thin films on high-touch surfaces using mesoporous silica nanoparticles (MSNs) that were specifically functionalized to enable strong adhesion and sustained release of metal-based antimicrobial agents. The process is scalable and addresses key challenges in adhesion control, film homogeneity, and long-term antimicrobial function against a large range of key pathogens responsible for nosocomial infections. Three distinct types of MSNs – bearing amine (MSN-NH₂), carboxy (MSN-COOH), and thiol (MSN-SH) surface groups – were synthesized to optimize both metal ion loading and interactions with polyelectrolyte-based adhesion layers. These surface modifications not only provide chemical handles for Cu²⁺ and Ag⁺ ion coordination but also modulate nanoparticle-substrate interactions and dispersion behavior during film formation. The coating architecture consists of a two-step process: first, spray deposition of polyelectrolyte primers that anchor strongly to stainless steel substrates; second, a nanoparticle layer that bonds electrostatically and chemically to the primer, forming robust films with great surface coverage. The films were characterized to assess structural integrity, adhesion, and functional performance. Transmission electron microscopy (TEM) and N₂ sorption analysis confirmed the mesoporous structure. ATR-FTIR and zeta potential measurements validated surface functionalization and colloidal stability. Environmental SEM revealed conformal coating across the stainless-steel surfaces with uniform nanoparticle distribution. The coating's adhesion strength was maintained through mechanical wiping and simulated wear and abrasion tests, demonstrating film durability relevant in real-world use scenarios. Antimicrobial testing under semi-dry, application-relevant conditions showed excellent performance for Ag⁺-loaded MSN-SH films, inhibiting growth of Staphylococcus aureus, Pseudomonas aeruginosa, Escherichia coli, and Candida albicans. These results highlight the synergistic role of surface chemistry, metal ion loading, and film-substrate adhesion in creating effective and wear-resistant functional coatings. Moreover, these films do not show any cytotoxic properties towards Human Dermal Fibroblasts (HDF). This study contributes new insights into the design of multifunctional films where adhesion, surface functionality, and scalable processing are co-optimized for enhanced performance and shows how combining tailored surface chemistry and wide-ranging antimicrobial activity brings together smart material design for practical and safe use.
T2 - MRS Fall Meeting 2025
CY - Boston, MA, USA
DA - 30.11.2025
KW - Mesoporous silica nanoparticles
KW - Silver
KW - Antimicrobial
KW - Coatings
KW - Thin film
PY - 2025
AN - OPUS4-65150
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Arai, Marylyn S.
A1 - Brambilla, Gabriel V.
A1 - Corrêa, Bruna Carolina
A1 - Merízio, Leonnam G.
A1 - Inada, Natalia M.
A1 - de Camargo, Andrea S. S.
T1 - A Dual-Mode “Turn-On” Ratiometric Luminescent Sensor Based on Upconverting Nanoparticles for Detection and Differentiation of Gram-Positive and Gram-Negative Bacteria
N2 - Infectious bacterial diseases, intensified by antibiotic resistance, cause millions of deaths annually and pose risks beyond human health, including water and food contamination. Current diagnostics are often slow, require complex equipment, and lack specificity, highlighting the need for rapid and reliable detection methods. To address this, we developed a luminescent sensor based on NaYF4 upconverting nanoparticles (UCNPs) doped with Er3+ or Tm3+, coated with COOH-PEG4-COOH, and functionalized with vancomycin (Van) or polymyxin-B (Poly) to selectively target Gram-positive and Gram-negative bacteria, respectively. Gold nanoparticles (AuNPs) served as quenchers, enabling a ratiometric “turn-on” mechanism: upon bacterial binding, the UCNP emission, initially quenched by AuNPs, was partially restored. This allowed Differentiation through changes in the green/red (G/R) ratio for Er-UCNP@PEG4-Van and the blue/red (B/R) ratio for Tm-UCNP@PEG4-Poly. The sensor distinguished between Gram-positive and Gram-negative bacteria over a wide concentration range (0.05 to 5 × 105 CFU/mL) and showed high correlation with actual bacterial counts (r = 0.99 for S. aureus, r = 0.91 for E. coli). This platform is a potential fast, selective, and reliable tool for bacterial detection in clinical and environmental settings.
KW - Lminescent sensor
KW - Upconverting nanoparticles
KW - Gram-positive and Gram-negative bacteria
KW - Ratiometric luminescent sensors
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-652785
DO - https://doi.org/10.1021/acsomega.5c07006
SN - 2470-1343
VL - 10
IS - 39
SP - 46040
EP - 46050
PB - American Chemical Society (ACS)
AN - OPUS4-65278
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Arai, Marylyn Setsuko
A1 - Machado, Thales Rafael
A1 - da Silva, Beatriz Giacomelli Rodrigues
A1 - Vilela, Raquel Riciati do Couto
A1 - de Camargo, Andrea Simone Stucchi
A1 - Zucolotto, Valtencir
T1 - Biomimetic Upconverting Nanoplatforms for Glioblastoma Bioimaging and Targeted Therapy
N2 - Infectious bacterial diseases, intensified by antibiotic resistance, cause millions of deaths annually and pose risks beyond human health, including water and food contamination. Current diagnostics are often slow, require complex equipment, and lack specificity, highlighting the need for rapid and reliable detection methods. To address this, we developed a luminescent sensor based on NaYF4 upconverting nanoparticles (UCNPs) doped with Er3+ or Tm3+, coated with COOH-PEG4-COOH, and functionalized with vancomycin (Van) or polymyxin-B (Poly) to selectively target Gram-positive and Gram-negative bacteria, respectively. Gold nanoparticles (AuNPs) served as quenchers, enabling a ratiometric “turn-on” mechanism: upon bacterial binding, the UCNP emission, initially quenched by AuNPs, was partially restored. This allowed differentiation through changes in the green/red (G/R) ratio for Er-UCNP@PEG4-Van and the blue/red (B/R) ratio for Tm-UCNP@PEG4-Poly. The sensor distinguished between Gram-positive and Gram-negative bacteria over a wide concentration range (0.05 to 5 × 105 CFU/mL) and showed high correlation with actual bacterial counts (r = 0.99 for S. aureus, r = 0.91 for E. coli). This platform is a potential fast, selective, and reliable tool for bacterial detection in clinical and environmental settings.
KW - Glioblastoma
KW - Homotypic targeting
KW - Cell membrane coating
KW - Upconverting nanoparticles
KW - Temozolamide
KW - Near infrared bioimaging
KW - Drug delivery
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-652808
DO - https://doi.org/10.1021/acsanm.5c04567
SN - 2574-0970
VL - 10
IS - 39
SP - 1
EP - 13
PB - American Chemical Society (ACS)
AN - OPUS4-65280
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - CONF
A1 - de Camargo, Andrea
A1 - Arai, Marylyn Setsuko
T1 - Upconversion nanoparticles for chemical, physical and biological sensing: from functionalization to point-of-care devices
N2 - Among several applications, versatile upconversion nanoparticles (UCNPs) which can convert lower-energy infrared radiation into higher-energy visible or ultraviolet light, have emerged as one of the most powerful tools in the field of chemical, physical and biological sensing. The use of UCNPs in fluorescent sensors allows non-invasive, highly sensitive, and selective detection methods, which are particularly beneficial in environments requiring minimal interference and high precision for analytes that can range from metal ions to biomolecules. In this lecture, an overview and the state of the art will be given, accompanied by examples of our recent contributions to key areas such as chronic disease diagnostics, bacterial sensing, and multifunctionally responsive nanoplatforms: (1) An Enhanced Luminescence Lateral-Flow Assay (ELLA) designed for rapid (< 15 min) and early detection of acute kidney injury biomarkers in urine samples, using a commercial cell phone camera, will be presented. The platform is based on Er³⁺- and Tm³⁺-doped UCNPs whose emissions intensities are 40-fold enhanced by an Au-coated mesoporous silica shell, enabling the accurate detection of KIM-1 and NGAL biomarkers with detection limits as low as 0.23 ng/mL; (2) Also, a multifunctional nanoplatform that combines Tm³⁺-doped UCNPs with a Cu(I) complex for applications in oxygen sensing, optical thermometry, and emission colour tuning will be presented. The platform utilizes Luminescent Resonance Energy Transfer (LRET) to achieve efficient energy transfer, enabling red emission from the Cu(I) complex while allowing the use of the UCNP’s original emissions for thermometry. The dual functionality allows sensitive O2 detection and temperature measurements, with relative sensitivities of up to 1% K⁻¹; (3) The critical challenge of rapid bacterial detection and differentiation was addressed by the development of a novel UCNP-based sensor. By functionalizing UCNPs with the antibiotics - vancomycin for Gram-(+) and polymyxin-B for Gram-(-), and using Au nanoparticles as intensity quenchers, the sensor leverages a ratiometric "turn-on" mechanism for selective detection of the bacteria, through changes in the green/red (G/R) ratio for Er-UCNP@PEG4-Van, and blue/red (B/R) ratio for Tm-UCNP@PEG4-Poly. By this approach, differentiation was possible over a wide concentration range of bacteria (0.05 to 5 x 105 CFU/mL) with high correlation with actual bacterial counts (r = 0.99 for S. aureus, r = 0.91 for E. coli); (4) Recently, we have demonstrated a water dispersable ratiometric pH-nanosensor based on host-guest interaction of Tm3+/Yb3+ co-doped UCNPs functionalized with b-cyclodextrin (b-CD) and a pH-responsive nitrobenzoxadiazol dye modified with adamantane (NBD-Ad). The sensor shows a ratiometric emission response (blue/red) over a pH range of 8.0 – 11.0 with high reproducibility, excellent reusability and selectivity, even in the presence of interferents. Together, the presented examples highlight the versatility and potential of UCNPs to develop novel sensors, offering measurable advances in diagnostics, environmental monitoring, and beyond.
T2 - Shift2025 - Spectral shaping for biomedical and energy applications
CY - Tenerife, Spain
DA - 13.10.2025
KW - Upconverting nanoparticles
KW - Fluorescent sensors
KW - Point-of-care devices
PY - 2025
AN - OPUS4-65282
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Hallier, Dorothea C.
A1 - Radnik, Jörg
A1 - Dietrich, Paul M.
A1 - Seitz, Harald
A1 - Hahn, Marc Benjamin
T1 - Radiation damage to amino acids, peptides and DNA-binding proteins: the influence of water directly monitored by X-ray photoelectron spectroscopy
N2 - Ionizing radiation damage to biomolecules plays a crucial role in radiotherapy as a cancer treatment. Among these, DNA-binding proteins are of particular interest due to their pivotal roles in shielding DNA and facilitating its repair. Hence, in this study, we present first-ever recorded data of radiation damage to a protein monitored directly with near-ambient pressure (NAP) X-ray photoelectron spectroscopy (XPS) under a water atmosphere. This surface sensitive technique was used to in situ damage and probe gene-V protein (G5P, a model DNA-binding protein) under wet NAP conditions and dry vacuum (UHV) conditions to determine the effect of water on the radiation response. In addition, the X-ray radiation damage to selected pure amino acids and short homopeptides was determined to better understand the variety of damage mechanisms within the complex protein. In dry samples, drastic chemical changes were detected in all biomolecules dominated by fragmentation processes. Here, the breakage of peptide
bonds in the peptides and the protein are dominant. Surprisingly, hydration – despite introducing additional indirect damage pathways via water radiolysis – led to a reduction in overall radiation damage. This behaviour was attributed to hydration-dependent changes in reaction rates and respective deexcitation and damaging channels within the molecules and secondary species such as low-energy (LEE), (pre)-hydrated/(pre)-solvated electrons and radical species such as hydroxyl radicals.
KW - Radiation damage
KW - (Near-ambient pressure) X-ray photoelectron spectroscopy
KW - Ultra-high vacuum
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-647565
DO - https://doi.org/10.1039/d5cp01887k
VL - 27
IS - 48
SP - 1
EP - 22
PB - Royal Society of Chemistry
AN - OPUS4-64756
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Amiri, Hesam
A1 - Nikookhesal, Aidin
A1 - Murugan, Divagar
A1 - Scholz, Stefan
A1 - Frentzen, Michael
A1 - Cao, Yuan
A1 - Nickl, Philip
A1 - Radnik, Jörg
A1 - Stockmann, Jörg M.
A1 - Vu, Xuan-Thang
A1 - Narayanan, Madaboosi S.
A1 - Knoch, Joachim
A1 - Ingebrandt, Sven
A1 - Adeli, Mohsen
A1 - Pachauri, Vivek
T1 - High precision correlative analysis of dielectric behavior evolution and anisotropy in graphene oxide thin film as a function of thermal annealing parameters
N2 - Graphene oxide (GO) and reduced graphene oxide (rGO) attract keen interest from different science and technology sectors owing to their tunable material characteristics dependent on C/O ratio. Thermal annealing in different gaseous environments serves as an effective approach to manipulate the C/O ratio in graphitic lattice, making it suitable for various electronic, optical and composites applications. Despite regular use of thermal annealing, systematic studies on dielectric properties evolution in GO against different annealing parameters remain elusive. This work reports on a reliable approach that adopts a joint Raman Spectroscopy, Mueller Matrix Spectroscopic Ellipsometry (MMSE) and high-precision electrical impedance spectroscopy (HP-EIS) framework for studying the evolution of dielectric behavior and anisotropies in GO. The experimental platform involved lithography-defined GO patterns connected to metal microelectrodes and glass passivation for protection from gaseous environments during annealing and measurements using Raman, MMSE and HP-EIS. The presented study delineates the effects of annealing parameters such as temperature, heating rate, and gaseous environment on GO permittivity. Novel findings include the discovery of a direct relationship between heating rate and dielectric properties, as well as determination of vertical limitation of MMSE for permittivity distribution characterization in GO, for the first time, to be around 8 nm.
KW - Thermal annealing
KW - Reduced graphene oxide
KW - Thin films
KW - 2D materials
KW - Spectroscopic ellipsometry
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-652428
DO - https://doi.org/10.1016/j.nwnano.2025.100130
SN - 2666-9781
VL - 11
SP - 1
EP - 10
PB - Elsevier Ltd.
AN - OPUS4-65242
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -
TY - JOUR
A1 - Tavernaro, Isabella
A1 - Rajotte, Isabelle
A1 - Thibeault, Marie-Pier
A1 - Sander, Philipp C.
A1 - Kodra, Oltion
A1 - Lopinski, Gregory
A1 - Radnik, Jörg
A1 - Johnston, Linda J.
A1 - Brinkmann, Andreas
A1 - Resch-Genger, Ute
T1 - Quantifying surface groups on aminated silica nanoparticles of different size, surface chemistry, and porosity with solution NMR, XPS, optical assays, and potentiometric titration
N2 - We assessed the quantification of surface amino functional groups (FGs) for a large set of commercial and custom-made aminated silica nanoparticles (SiO2 NPs) with sizes of 20–100 nm, prepared with different sol–gel routes, different amounts of surface amino FGs, and different porosity with four methods providing different, yet connected measurands in a bilateral study of two laboratories, BAM and NRC, with the overall aim to develop standardizable measurements for surface FG quantification. Special emphasis was dedicated to traceable quantitative magnetic resonance spectroscopy (qNMR) performed with dissolved SiO2 NPs. For the cost efficient and automatable screening of the amount of surface amino FGs done in a first step of this study, the optical fluorescamine assay and a potentiometric titration method were utilized by one partner, i.e., BAM, yielding the amount of primary amino FGs accessible for the reaction with a dye precursor and the total amount of (de)protonatable FGs. These measurements, which give estimates of the minimum and maximum number of surface amino FGs, laid the basis for quantifying the amount of amino silane molecules with chemo-selective qNMR with stepwise fine-tuned workflows, involving centrifugation, drying, weighting, dissolution, measurement, and data evaluation steps jointly performed by BAM and NRC. Data comparability and relative standard deviations (RSDs) obtained by both labs were used as quality measures for method optimization and as prerequisites to identify method-inherent limitations to be later considered for standardized measurement protocols. Additionally, the nitrogen (N) to silicon (Si) ratio in the near-surface region of the SiO2 NPs was determined by both labs using X-ray photoelectron spectroscopy (XPS), a well established surface sensitive analytical method increasingly utilized for microparticles and nano-objects which is currently also in the focus of international standardization activities. Overall, our results underline the importance of multi-method characterization studies for quantifying FGs on NMs involving at least two expert laboratories for effectively identifying sources of uncertainty, validating analytical methods, and deriving NM structure–property relationships.
KW - Advanced Materials
KW - Amino Groups
KW - Calibration
KW - Characterization
KW - Functional groups
KW - Method Comparison
KW - Nano Particle
KW - Validation
KW - XPS
KW - Optical Assay
KW - Quantification
KW - Surface Analysis
KW - Reference Materials
KW - Synthesis
KW - Fluorescence
PY - 2025
UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-649992
DO - https://doi.org/10.1039/d5na00794a
VL - 7
IS - 21
SP - 6888
EP - 6900
PB - Royal Society of Chemistry
AN - OPUS4-64999
LA - eng
AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany
ER -