TY - JOUR A1 - Rodríguez‐Sánchez, Noelia A1 - Ballesteros, Menta A1 - Prinz, Carsten A1 - Canosa, Inés A1 - Flores Díaz, Amando A1 - Bhattacharya, Biswajit A1 - Ruiz‐Salvador, A. Rabdel A1 - Emmerling, Franziska T1 - Mechanochemical Fullerene Nanoencapsulation in Amino‐Functionalized ZIF‐12 for Visible‐Light Disinfection of Waterborne Viruses and Bacteria N2 - Water contamination poses a significant threat to public health and environmental sustainability, necessitating the development of efficient purification technologies. This study reports the mechanochemical synthesis of an amino-functionalized ZIF 12 framework with encapsulated fullerene (C60) as a bifunctional photocatalyst for water decontamination and disinfection under visible-light irradiation. The samples were characterized using powder X-ray diffraction (PXRD), FT-IR spectroscopy, N2 adsorption isotherm, X-ray photoelectron spectroscopy (XPS), electron microscopy (SEM and TEM), thermogravimetric Analysis (TGA), and UV–vis diffuse reflectance spectroscopy (DRS), confirming the retention of crystallinity and effective incorporation of C60 and amino groups within the framework. Fullerene loading and amino functionalization modified the optical properties, extending visible light absorption and enhancing charge separation and photocatalytic activity. The synergistic interaction between amino groups and C60 promotes efficient charge separation and enhanced hydroxyl radical production, resulting in improved photocatalytic and photo-Fenton activity. C60@ZIF-12-NH2 exhibited excellent photocatalytic performance, achieving the completeinactivation of bacteriophage P22 under saline conditions and effective disinfection of E.coli and coliforms innatural river water, demonstrating robustness under environmentally relevant conditions. The solvent-minimized mechanochemical synthesis and visible-light-driven activity position the C60@ZIF-12-NH2 composite as a promising platform for sustainable and advanced water treatment applications. KW - Fullerene KW - Heterogeneous photo-Fenton KW - Mechanochemistry KW - Nanoencapsulation KW - Photocatalysis KW - ZIF-12 PY - 2026 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-656531 DO - https://doi.org/10.1002/smll.202512881 SN - 1613-6810 SP - 1 EP - 19 PB - Wiley-VCH GmbH AN - OPUS4-65653 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Dalgic, Mete‐Sungur A1 - Kumar, Sourabh A1 - Weidner, Steffen T1 - Quantitative Analysis of Polymers by MALDI‐TOF Mass Spectrometry: Correlation Between Signal Intensity and Arm Number N2 - The signal intensities of linear and star‐shaped poly(L‐lactides) (PLA) and poly (ethylene oxides) (PEO) were compared to determine the influence of the number of arms on the ionization in matrix‐assisted laser desorption/ionization time‐of‐flight (MALDI‐TOF) mass spectrometry. In this study, a variety of blends were prepared and investigated, including binary and ternary combinations of linear and star‐shaped polymers with similar molecular masses. The focus was on examining their intensity ratios. In equimolar binary PLA blends, polymer stars were observed to exhibit higher intensities than their linear counterparts. This result was supported by experiments with equimolar ternary PLA blends, which clearly demonstrated an intensity dependence on the number of polymer arms. It was observed that four‐arm PLA exhibited higher intensities than three‐arm PLA. A similar trend was observed in investigations involving acetylated polymer end groups, suggesting that differences in ionization are primarily influenced by polymer architecture rather than end groups. In order to validate this assumption, the binding energies for [polymer‐K] + adduct ions utilizing the most stable geometry obtained from GOAT (Global Optimizer Algorithm) were calculated, revealing that star‐shaped lower mass oligomers have slightly higher binding energies. KW - MALDI-TOF MS KW - Starlike polymers KW - Quantification KW - Topology PY - 2026 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-653401 DO - https://doi.org/10.1002/jms.70023 SN - 1076-5174 VL - 61 IS - 1 SP - 1 EP - 12 PB - John Wiley & Sons Ltd. AN - OPUS4-65340 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Mrkwitschka, Paul A1 - Sahre, Mario A1 - Corrao, Elena A1 - Pellegrino, Francesco A1 - Alonso, Beatriz A1 - Zurutuza, Amaia A1 - Radnik, Jörg A1 - Hodoroaba, Vasile-Dan T1 - Standardized Elemental Composition Analysis of Graphene‐Related 2D Materials (GR2M) With SEM/EDS and XPS Works Reliably N2 - Reliable quantification of the chemical composition of graphene‐related 2D materials (GR2M) as powders and liquid suspensions is a challenging task. Analytical methods such as X‐ray photoelectron spectroscopy (XPS), inductively coupled plasma mass spectrometry (ICP‐MS), thermogravimetric analysis (TGA) and Fourier transform infrared spectroscopy (FTIR) are recommended by standardization bodies. The specific parameters to be measured are also defined, e.g., the oxygen‐to‐carbon (O/C) atomic ratio, the trace metal impurities, or the functional groups. In this contribution, for the first time, results of a systematic study on the capability of energy‐dispersive X‐ray spectroscopy (EDS) at a scanning electron microscope (SEM) to reliably quantify the O/C ratio and impurities remained from the synthesis of selected GR2M are reported. The robustness of SEM/EDS analysis is verified for various measurement conditions (different excitations and EDS detectors) and the validity of the results is tested by comparison to the established XPS analysis. Moreover, an ionic liquid is used as a reference material for the quantification of the light elements such as C, N, O and F. The study clearly demonstrates the reliability of the fast and widely available SEM/EDS as a standard method for the quantification of the elemental composition of GR2M and generally of light materials. KW - Graphene oxide flakes KW - Impurities KW - O/C ratio KW - SEM/EDS KW - Standard KW - XPS PY - 2026 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-656748 DO - https://doi.org/10.1002/smll.202511283 SN - 1613-6810 SP - 1 EP - 10 PB - Wiley-VHC GmbH AN - OPUS4-65674 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Aliyah, K. A1 - Berger, A. A1 - Lazaridis, T. A1 - Appel, C. A1 - Prehal, C. A1 - Menzel, A. A1 - Guizar-Sicairos, M. A1 - Smales, Glen J. A1 - Pauw, Brian Richard A1 - Gasteiger, H. A. A1 - Gubler, L. A1 - Büchi, F. N. A1 - Eller, J. T1 - Impact of Microporous Layer Composition on the Water Content in the Membrane Electrode Assembly of Polymer Electrolyte Fuel Cells N2 - Polymer electrolyte fuel cells are paramount for future emission-free mobility. One of the vital challenges for prospering commercialization of PEFCs is water management in the cells. A microporous layer (MPL) is typically positioned between the gas Diffusion layer (GDL) and the catalyst layer (CL) to boost the cell performance and facilitate water management. In this study, three different MPLs were investigated, namely, carbon black-based MPLs with different PTFE binder contents (20 wt % PTFE as a base case and 40 wt % PTFE), as well as perforated MPLs with micron-sized pores coated on the same GDL- Substrate (Freudenberg H14). The water content in the membrane, catalyst layers (CL), and MPLs was explored using operando scanning small- and wide-angle X-ray scattering (S/WAXS). At Tcell = 80 °C, relative humidity = 100%, pabs = 3 bar, the MPL with larger pores exhibits slightly higher performance than the base case, while a considerably lower cathode CL and MPL saturation levels were observed for the MPL. In contrast, the MPL with higher amounts of PTFE binder shows lower performance than the base case, with considerably higher cathode CL and MPL saturation levels. 3D representations of how the pores could be filled in the cathode CLs were obtained from operando SAXS profiles using representative structure modeling for the different materials and operating conditions. KW - Polymer electrolyte fuel cell KW - Catalyst layer saturation KW - Microporous layer saturation KW - Membrane hydration KW - Small and wide-angle scattering KW - MOUSE KW - SAXS KW - X-ray scattering KW - Energy storage materials PY - 2026 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-656691 DO - https://doi.org/10.1021/acsami.5c22540 SN - 1944-8244 SP - 1 EP - 17 PB - American Chemical Society (ACS) AN - OPUS4-65669 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Sanchez-Olivares, Guadalupe A1 - Brehme, Sven A1 - Calderas, F. A1 - Schartel, Bernhard T1 - Flame Retardant Polyolefins Using Fibers From Leather Waste: Adjusting Extrusion Variables to Balance the Property Profile N2 - The extrusion processing variables represent a key to the optimal use of additives and thus the development of flame-retardant polymer composites. Adjusting the property profile, for example, finding a balance between flame retardancy and mechanical properties is the main challenge. In this work, the effect of blending temperature and rotational speed on physico-mechanical properties and fire behavior of polyolefin composites was investigated. High-density polyethylene or polypropylene was used as polymer matrices; the polymers were compounded by the extrusion process using industrial-waste leather fibers as flame retardant adjuvant and commercial flame-retardant additives. A detailed rheological analysis highlighted different viscoelastic behavior, that is, a predominant elastic or viscous one. The effect of the extrusion processing variables was also investigated on the morphology, mechanical properties, thermal decomposition, fire behavior under forced flaming combustion and flammability. Important improvements were revealed with respect to using only high loading of flame retardants. For high-density polyethylene-based composites, impact resistance and elongation at break increased 8 and 7.5 times, respectively. The total heat evolved (87MJ/m2), effective heat of combustion (31.6MJ/kg), flame retardancy (UL 94 rating) results were comparable with the reference sample. Meanwhile for polypropylene composites, the impact resistance increased 2.2 times and the flame retardancy was improved from no rating in the UL 94 vertical test to V-0 rating. Tailored processing was highlighted as an autonomous and powerful approach to achieve balanced and demanding properties. KW - Biomaterials KW - Composites KW - Extrusion KW - Flame retardance KW - Leather waste KW - Polyolefins PY - 2026 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-656732 DO - https://doi.org/10.1002/vnl.70048 SN - 1548-0585 SN - 1083-5601 VL - 32 IS - 2 SP - 410 EP - 430 PB - Wiley Periodicals LLC. AN - OPUS4-65673 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Charlesworth, M. A1 - Lampronti, G. A1 - Belenguer, Ana M. A1 - Day, S. A1 - Saunders, L. A1 - Connolly, E. A1 - Midgley, P. A1 - Michalchuk, Adam A. L. T1 - Influence of Liquid on Crystallite Size Evolution During Ball Milling N2 - Liquid assisted grinding (LAG) is a commonly used mechanochemical procedure, especially for polymorphic conversions. However, it is not understood what effect liquid additives actually play in driving mechanochemical polymorphic conversions, precluding our ability to control solid form transformations under mechanochemical conditions. We here present a time-resolved in situ (TRIS) synchrotron powder Xray diffraction (PXRD) monitoring strategy that can track, with few nm resolution, the evolution of crystalline size under liquid assisted ball milling conditions. We apply this method to investigate the influence of liquid additives on the polymorphic conversion of the 1:1 co-crystal of theophylline and benzamide, with particular focus on the role that crystallite size plays in driving ball milling induced polymorphic transformations. We find that the crystallite sizes achieved by ball milling are highly sensitive to the amount of liquid added to the reaction mixture. Liquid additives generally lead to larger crystallite sizes as compared with neat grinding protocol, with our findings indicating that crystallite size reduction is not the main factor that causes polymorph conversion under liquid assisted grinding conditions. The data presented clearly indicates the presence of an induction period before phase transformation begins with a minimum value in the crystallite size of the starting polymorph indicating the end of that induction period. KW - Ball milling KW - In situ diffraction KW - Phase transformation KW - Liquid assisted grinding KW - Crystallite size PY - 2026 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-656783 DO - https://doi.org/10.1021/acs.cgd.5c01662 SN - 1528-7483 SP - 1 EP - 7 PB - American Chemical Society (ACS) AN - OPUS4-65678 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Meng, Xiangmeng A1 - Bachmann, Marcel A1 - Kising, Pascal A1 - Yang, Fan A1 - Rethmeier, Michael T1 - Prediction of weld pool and keyhole geometries in high-power laser beam welding through a physics-informed generative artificial intelligence approach N2 - The weld pool and keyhole geometries are critical characteristics in evaluating the stability of the high-power laser beam welding (LBW) process and determining the resultant weld quality. However, obtaining these data through experimental or numerical methods remains challenging due to the difficulties in experimental measurements and the high computational demands of numerical modelling. This paper presents a physics-informed generative approach for predicting weld pool and keyhole geometries in the LBW process. With the help of a well experimentally validated numerical model considering the underlying physics in the LBW, the geometries of the weld pool and keyhole under various welding conditions are calculated, serving as the dataset of the generative model. A conditional variational autoencoder model is employed to generate realistic 2D weld pool and keyhole geometries from the welding parameters. We utilize a β-variational autoencoder model with the evidence lower bound loss function and include Kullback–Leibler divergence annealing to better optimize model performance and stability during training. The generated results show a good agreement with the ground truth from the numerical simulation. The proposed approach exhibits the potential of physics-informed generative models for a rapid and accurate prediction of the weld pool geometries across a diverse range of process parameters, offering a computationally efficient alternative to full numerical simulations for process optimization and control in laser beam welding processes. KW - Laser beam welding KW - Generative artificial intelligence KW - Machine learning KW - Numerical simulation KW - Weld pool KW - Keyhole dynamics PY - 2026 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-656621 DO - https://doi.org/10.2351/7.0001862 SN - 1042-346X VL - 38 IS - 1 SP - 1 EP - 8 PB - Laser Institute of America AN - OPUS4-65662 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Scharek, Vera M. A1 - Traub, Heike A1 - Meermann, Björn T1 - A direct solid sampling approach for fluorine determination via ETV/ICP-QQQ-MS N2 - Organic fluorine sum parameters are used to detect F-containing pollutants, e.g., per- and polyfluoroalkyl substances (PFASs), in the environment, within materials, or for monitoring technical processess, e.g., thermal decomposition of PFAS during municipal waste incineration. However, established approaches determining the extractable organic and adsorbable organic fluorine content (EOC and AOC) require laborious and error-prone sample preparation. We report a solid sampling-electrothermal vaporization (ETV) method for direct fluorine measurement based on the formation of [138Ba19F]+ with an inductively coupled plasma-triple quadrupole-mass spectrometer (ICP-QQQ-MS). Method development involved the instrumental setup for Ba introduction and fluorine-specific tuning of lens and collision-reaction cell (CRC) parameters. An inorganic fluorine fraction was detected in a cyclonic dust sample from a municipal waste incineration plant as a peak above a broad background signal. The content was estimated through standard addition using a NaF solution to 2300 mgg−1. With a limit of detection (LOD) of 130 mg g−1, which was below the reported value for an electrothermal vaporization/inductively coupled plasma-mass spectrometry (ETV/ICP-MS) approach, acquiring [19F]+. The method's potential for fractionation analysis was demonstrated by analyzing polytetrafluoroethylene (PTFE) powder. KW - PFAS KW - ETV/ICP-QQQ-MS KW - Solid sampling PY - 2026 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-656766 DO - https://doi.org/10.1039/d6ja00014b SN - 0267-9477 SP - 1 EP - 7 PB - Royal Society of Chemistry (RSC) AN - OPUS4-65676 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - El Abbassi, Abdelouahad A1 - Krenzer, Julius A1 - Petrov, Eugene P. A1 - Biesen, Lukas A1 - Vasylyeva, Vera A1 - Merzenich, Sarah A1 - Resch-Genger, Ute A1 - Müller, Thomas J. J. T1 - Aroyl-S,N-ketene acetal-triarylamine bichromophores – intramolecular energy transfer and dual emission upon induced aggregation and encapsulation N2 - Aroyl-S,N-ketene acetal-based bichromophores are synthesized by a catalytic aryl amination and their photophysics are studied in the solid state, in ethanol–water mixtures inducing aggregation, and after encapsulation in polystyrene nanoparticles. The dye substitution pattern controls aggregation-induced emission and intramolecular energy transfer efficiency, resulting in single-band or dual fluorescence and a strong increase in fluorescence quantum yield upon particle encapsulation. KW - Fluorescence KW - Dye KW - Aggregation KW - Photophysics KW - Enhancement KW - White light emission KW - Energy transfer KW - Quantum yield PY - 2026 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-656700 DO - https://doi.org/10.1039/d5ra09361a SN - 2046-2069 VL - 16 IS - 11 SP - 10255 EP - 10260 PB - Royal Society of Chemistry (RSC) AN - OPUS4-65670 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Pittrich, Tim A1 - Peters, Simon A1 - Meschke, Günther A1 - Weise, Frank A1 - Stelzner, Ludwig T1 - Thermally induced moisture transport in concrete with different types of blended Portland cement studied by 1H-NMR relaxometry N2 - Clinker-reduced cements are gaining in popularity as part of efforts to lower the construction industry’s CO2 footprint. Past studies showed that utilization of these cements negatively influences the fire-induced spalling behavior of concrete, which is highly influenced by thermohydraulic damage mechanisms. Therefore, thermally induced moisture transport in normal strength concretes made with different types of blended cements (CEM I, CEM II/A-LL, CEM III/A and CEM II/B-Q) was investigated by means of 1H-NMR relaxometry in combination with supportive side investigations concerning permeability and porosity. In addition, a numerical model was used to analyze in-situ moisture development during high temperature exposure. The results show that the cement type influences both initial moisture content and pore size-specific moisture distribution. This was primarily reflected in an increased water content in CEM III/A and CEM II/B-Q concretes as well as a comparable high gel pore water fraction in CEM II/B-Q concrete before heating. After heating, a similar degree of pore coarsening from gel to capillary pore was observed in all samples. Although the measurements were only conducted after, not during, high temperature exposure, the depth of the drying front and the extent of the moisture clog could be determined. With the additional numerical analysis, it can be assumed that during high temperature load, the drying front is less advanced and the moisture clog even more pronounced. In conclusion, it can be stated that the increased spalling susceptibility in blended cement concrete is caused by the lower initial permeability and increased moisture content. KW - Fire concrete spalling KW - Thermally induced moisture transport KW - Blended cements KW - 1H-NMR PY - 2026 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-656846 DO - https://doi.org/10.1617/s11527-026-03025-4 SN - 1359-5997 VL - 59 IS - 3 SP - 1 EP - 20 PB - Springer Science and Business Media LLC AN - OPUS4-65684 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Scharf-Wildenhain, R. A1 - Engelking, Lorenz A1 - Hälsig, A. A1 - Schröpfer, Dirk A1 - Kannengießer, Thomas A1 - Hensel, J. T1 - Influence of build‑up height on residual stresses in additive repair and modification using DED‑Arc with high‑strength filler metals N2 - Directed energy deposition (DED)-Arc is suitable for the hybrid additive manufacturing, modification and repair of large metal components with high deposition rates. Residual stresses and distortion are of central importance when characterizing the manufactured components and the sensitive transition area between additive manufactured (AM) component and semifinished product. Residual stresses caused by the thermal cycles during the manufacturing process can impair the mechanical properties of the manufactured parts and can lead to component failure, especially for high-strength steels. Therefore, understanding and controlling residual stresses, when combining different base and feedstock materials, is critical to improve the quality and efficiency of the hybrid DED-Arc process. This article deals with the influence of the build-up height on the residual stress distribution of additively manufactured components with a selected base and feedstock material from commercial high-strength steels. Using a robot-assisted DED-system and a controlled short arc, AM welding experiments were carried out with close to the application parameters at working temperature (200 °C) and heat input (650 kJ/m). Five hybrid AM specimens (AM wall on upright structural steel plate) were produced using a one bead per layer strategy and selected AM-wall heights between 15 and 300 mm. The influence of the AM build height on the longitudinal residual stress in the whole hybrid AM specimen (in welding direction) was analyzed and discussed. All experiments exhibit comparable stress distributions in the area of the substrate plate up to the heat-affected zone (HAZ) and the transition zone, regardless of the building height. The height significantly influences the residual stress distribution of the deposited AM-component. Tensile residual stresses with a maximum range between 300and 400 MPa were always found in the last approx. 18 component layers (upper 40 mm). This is due to restraint of the shrinking of the top layers by the layers below. The lower layers show homogeneous residual stress distributions characterized by low compressive stresses due to the process-related tempering during the deposition of each layer on top of each other. As a result, the significant difference between the various AM build-up heights of the hybrid AM specimens is the extent (or height) of this tempered zone with low compressive stresses. These correlations contribute to the understanding of residual stress development with increasing structure height or ratio of component heights of substrate semi-finished product and AM component in hybrid additive manufacturing. T2 - 78th IIW Annual Assembly and International Conference CY - Genoa, Italy DA - 22.06.2025 KW - DED-Arc KW - Residual stress KW - Heat control PY - 2026 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-656793 DO - https://doi.org/10.1007/s40194-026-02417-y SN - 1878-6669 SP - 1 EP - 12 PB - Spriner AN - OPUS4-65679 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Roß, Marcel A1 - Severin, Stefanie A1 - Hildebrandt, Jana A1 - Erdmann, Kerstin A1 - Miaskiewicz, Aleksandra A1 - Škorjanc, Viktor A1 - Bernardes de Araujo, Wander Max A1 - Leyden, Matthew A1 - Korte, Lars A1 - Seeger, Stefan A1 - Dallmann, André A1 - Albrecht, Steve T1 - Compositional Analysis of Metal Halide Perovskites: Insight into the Coevaporation Process via Nuclear Magnetic Resonance and X-ray Fluorescence Spectroscopy N2 - Lead halide perovskites have emerged as a highly promising class of materials for solar cells. Nevertheless, suitable procedures to analyze the exact composition of the perovskite films are rare and are not generally applicable. Here we show a simple and fast method to determine the absolute composition of mixed metal halide perovskites through a combination of nuclear magnetic resonance and total reflection X-ray fluorescence spectroscopy. The method is validated on powder mixtures and applied to thin film samples prepared by coevaporation of formamidinium iodide (FAI), CsI, PbI2 and PbBr2, allowing correlation between film composition and solar cell performance. We show that the rates of the individual precursors do not always translate linearly into film composition and that the preparation of the hole transport layer MeO-2PACz strongly influences the incorporation of FAI. Our work highlights the importance of compositional analysis and demonstrates how the developed method provides new insights into the complex coevaporation process in perovskite solar cells. KW - e‑ray Fluorescence Spectroscopy KW - Metal Halide Perovskites KW - CoevaporationP rocess KW - Nuclear Magnetic Resonance PY - 2026 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-656932 DO - https://doi.org/10.1021/acsenergylett.5c03689 SN - 2380-8195 VL - 11 IS - 2 SP - 1935 EP - 1943 PB - American Chemical Society (ACS) AN - OPUS4-65693 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Witte, Julien A1 - Treutler, Kai A1 - Schroepfer, Dirk A1 - Kannengiesser, Thomas A1 - Wesling, Volker T1 - Influence of microstructure on the machinability and surface integrity of additively manufactured iron aluminides N2 - The increasing global focus on energy and resource efficiency has stimulated a growing interest in additive manufacturing. AM offers economic advantages and enables an efficient use of materials. However, AM components often require subsequent mechanical post-processing, such as machining (e.g., milling), to achieve the final contours or surfaces. This is a particular challenge due to the heterogeneous and anisotropic nature of AM structures, which affect machining and the resulting component properties. High-performance materials such as iron aluminide represent a promising alternative to conventional high-temperature materials with a significant economic advantage. However, the strength and hardness properties, which are advantageous for applications in highly stressed lightweight components, pose a challenge for economical machining in addition to the AM microstructure properties. The difficult-to-cut material causes accelerated tool wear and insufficient surface quality. This study shows that crack-free additive manufacturing of the three-component system of iron-nickel-aluminum is possible, and advantages in terms of machinability compared to FeAl-AM components are achieved. The more homogeneous microstructure leads to a reduction in cutting forces, with positive effects on the machinability and optimized surface integrity. Ultrasonic assisted milling (USAM) offers great potential to address the major challenges posed by difficult-to-cut materials and additively manufactured weld structures. Therefore, this study focuses on assessing the transferability of previous positive results by USAM to the selected iron aluminide alloys. The machinability of the aluminides is analyzed by varying significant influencing variables in finish milling experiments and evaluated in terms of the loads on the tool and the resulting surface integrity. KW - Iron aluminide KW - Additive manufacturing KW - Machinability KW - Surface integrity KW - Ultrasonic-assisted milling process PY - 2026 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-656993 DO - https://doi.org/10.1007/s40194-026-02382-6 SN - 0043-2288 SP - 1 EP - 13 PB - Springer Science and Business Media LLC AN - OPUS4-65699 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Simon, Fabian A1 - von der Au, Marcus A1 - Gehrenkemper, Lennart A1 - Meermann, Björn T1 - An optimized method for PFAS analysis using HR–CS–GFMAS via GaF detection N2 - The analysis of per- and polyfluoroalkyl substances (PFAS) via sum parameters like extractable organic fluorine (EOF) in combination with high resolution-continuum source-graphite furnace molecular absorption spectrometry (HR–CS–GFMAS) is highly promising regarding fluorine sensitivity and selectivity. However, the HR–CS–GFMAS method includes several drying and heating steps which can lead to losses of volatile PFAS before the molecular formation step using e.g., GaF formation. Hence, the method leads to a strong discrimination of PFAS within the EOF depending on their physical/chemical properties and is therefore associated with reduced accuracy. To reduce this discrepancy and to indicate realistic PFAS pollution values, an optimization of the HR–CS–GFMAS method for PFAS analysis is needed. Hence, we determined fluorine response factors of several PFAS with different physical/chemical properties upon application of systematic optimization steps. We could therefore improve the method's sensitivity for PFAS analysis using a modifier drying pre-treatment step followed by a sequential injection of sample solutions. The highest improvement in sensitivity of volatile PFAS was shown upon addition of a Mg modifier during drying pre-treatment. Thereby, during optimization the relative standard deviation of fluorine response factors could be reduced from 55 % (initial method) to 27 % (optimized method) leading to a more accurate determination of organofluorine sum parameters. The method provides an instrumental LOD and LOQ of β(F) 1.71 μg/L and 5.13 μg/L, respectively. Further validation aimed to investigate several matrix effects with respect to water matrices. Here, substance-specific behavior was observed. For example, perfluorooctanoic acid (PFOA) which was used as calibrator, showed signal suppressions upon high chloride concentrations (>50 mg/L). Hence, a thorough separation of Cl from analytes during sample preparation is needed for accurate sum parameter analysis. KW - PFAS KW - GF-AAS KW - Method optimization PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-610522 DO - https://doi.org/10.1016/j.talanta.2024.126811 VL - 281 SP - 1 EP - 11 PB - Elsevier B.V. AN - OPUS4-61052 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Lu, Xin A1 - Krebber, Katerina T1 - Suppression of Rayleigh fading induced errors in φOTDR by different pulse widths for improving the reliability of civil infrastructure monitoring N2 - Rayleigh fading is a widely observed phenomenon in the many fields, such as wireless communication and optical imaging. It is also the main factor limiting the performance of the phase-sensitive optical time domain reflectometry (φOTDR). The low SNR at the fading points results in a large measurement error, severely affecting the reliability of civil infrastructure monitoring. The proposed method involves changing the pulse width during measurements to suppress the impact of fading. Experimental result shows that the number of fading points is greatly reduced by ∼ 96 % and the measurement error is reduced by more than 5 times. Unlike existing methods, this approach requires no hardware modifications, making it applicable to almost all current phase-based φOTDR systems. The versatility and effectiveness of this method make it an excellent candidate for infrastructure monitoring and related fields. KW - Distributed fiber sensing KW - Optical fiber sensing KW - Phase-sensitive optical time domain reflectometry KW - Infrastructure monitoring KW - Rayleigh fading PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-614208 DO - https://doi.org/10.1016/j.optlastec.2024.111927 SN - 1879-2545 VL - 181 SP - 1 EP - 9 PB - Elsevier Ltd. AN - OPUS4-61420 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Krone, David A1 - Esche, Erik A1 - Skiborowski, Mirko A1 - Repke, Jens-Uwe T1 - Optimization-based process synthesis by phenomena-based building blocks and an MINLP framework featuring structural screening N2 - An existing approach for optimization-based process synthesis with abstracted phenomena-based building blocks (PBB) is extended by implementing it into a novel MINLP framework with structural screening. Consistency across the multilayer MINLP framework is guaranteed by creating a MathML/XML data model and subsequently exporting the code to the different program parts. The novel framework focuses both on fidelity by implementing thermodynamically sound models and on generality by employing a state-space superstructure that spans a large search space. In order to retain tractability, we insert a structural screening layer which prescreens based on binary decision variables of the superstructure by graph- and rule-based analyses, penalizing non-physical instances without solution of the underlying MINLP. The MINLP framework is successfully applied on two challenging synthesis tasks to determine the separation of the feed streams of benzene and toluene, as well as of n-pentane, n-hexane, and n-heptane utilizing superstructures with two, respectively four PBB. KW - Process synthesis KW - Superstructure optimization KW - Distillation KW - Mathematical programming KW - Structural screening PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-621955 DO - https://doi.org/10.1016/j.compchemeng.2024.108955 VL - 194 SP - 1 EP - 19 PB - Elsevier Ltd. AN - OPUS4-62195 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Kärcher, Victor A1 - Reiker, Tobias A1 - da Costa, Pedro F.G.M. A1 - de Camargo, Andrea S.S. A1 - Zacharias, Helmut T1 - Quantum control in size selected semiconductor quantum dot thin films N2 - We introduce a novel technique for coherent control that employs resonant internally generated fields in CdTe quantum dot (QD) thin films at the L-point. The bulk band gap of CdTe at the L-point amounts to 3.6 eV, with the transition marked by strong Coulomb coupling. Third harmonic generation (λ3 = 343 nm, hν = 3.61 eV) for a fundamental wavelength of λ 1 = 1,030 nm is used to control quantum interference of three-photon resonant paths between the valence and conduction bands. Different thicknesses of the CdTe QDs are used to manipulate the phase relationship between the external fundamental and the internally generated third harmonic, resulting in either suppression or strong enhancement of the resonant third harmonic, while the nonresonant components remain nearly constant. This development could pave the way for new quantum interference–based applications in ultrafast switching of nanophotonic devices. KW - Nonlinear nanophotonics KW - Quantum interference KW - Third harmonic KW - Coherent control KW - Thin films KW - Quantum dots PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-625859 DO - https://doi.org/10.1515/nanoph-2024-0529 VL - 14 IS - 2 SP - 229 EP - 239 PB - Walter de Gruyter GmbH AN - OPUS4-62585 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Arai, Marylyn Setsuko A1 - Ravaro, Leandro Piaggi A1 - Brambilla, Gabriel A1 - Maia, Lauro June Queiroz A1 - Reza Dousti, Mohammad A1 - de Camargo, Andrea Simone Stucchi T1 - Upconverting Nanoparticles and Cu(I) Complex-Based Platform for Oxygen Sensing, Thermometry, and Emission Color Tuning N2 - Multifunctional nanoplatforms combine different material properties to meet a wide range of applications, allowing highly customizable systems. In this rapidly advancing research field, we introduce a multifunctional nanomaterial based on the synergy between Tm3+-doped upconverting nanoparticles (UCNPs) and a Cu(I) complex (CuCom). This material is designed for oxygen sensing, optical thermometry, and emission color tuning. In various concentrations, the CuCom complex was electrostatically integrated into a mesoporous silica shell surrounding the core UCNPs (UCNP@mSiO2). The optimized system, UCNP@mSiO2@CuCom-10, was evaluated for different applications. Due to the spectral overlap between the CuCom absorption and the nanoparticles emission, excitation at 980 nm allows most of the UV-blue emission output from the UCNPs to be transferred to the CuCom via luminescent resonance energy transfer (LRET), producing red emission from the molecule. The remaining Tm3+ emission enables optical thermometry, while CuCom’s sensitivity to molecular oxygen supports its application in gas sensing. In upconversion mode, the nanoplatform achieved a Stern−Volmer constant for O2 sensing of 1.64 and demonstrated thermometric relative sensitivities of 0.9% and 1% K−1 at room temperature, with a linear response from 193 to 373 K. Additionally, the emission color of UCNP@mSiO2@CuCom-10 can be tuned from blue to white and yellow, by varying the excitation and temperature, adding further functionality to the system. This multifunctional platform suggests promising applications in biology, medicine, and environmental monitoring. KW - M KW - O2 sensing KW - Upconversion KW - Luminescence resonance energy transfer (LRET) KW - Optical thermometry KW - Mesoporous silica shell PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-625869 SN - 2574-0970 DO - https://doi.org/10.1021/acsanm.4c06351 VL - 8 SP - 854 EP - 862 PB - American Chemical Society (ACS) AN - OPUS4-62586 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Valentini, Martino A1 - De Almeida, Olivier A1 - Kakkonen, Markus A1 - Kalinka, Gerhard A1 - Dorigato, Andrea A1 - Kallio, Pasi A1 - Fredi, Giulia T1 - Effect of fiber surface state on the thermomechanical and interfacial properties of in situ polymerized polyamide 6/basalt fiber composites N2 - This study investigates the thermomechanical properties and interfacial adhesion of novel in-situ polymerized anionic polyamide 6 (aPA6) composites reinforced with basalt fibers (BF). The impact of different BF surface states - as-received (BFa), ethanol-washed (BFw), and thermally desized (BFu) on composite performance is examined through a comprehensive approach. For the first time, anionic PA6/BF composites with very low residual monomer content were successfully produced via thermoplastic resin transfer molding (tRTM). The PA6/BFw composites exhibited the highest interlaminar/interfacial shear strength in short beam shear test (52 ±8 MPa) and fiber push out test (34 ± 11 MPa) tests. Fiber microdebonding test, performed only on PA6/BFw, yielded a low interfacial shear strength (12 ± 4 MPa), which was attributed to droplet porosity resulting from concurrent polymerization and crystallization. Thermal desizing significantly deteriorated interfacial strength (19.6 ± 1.2 MPa in short beam shear test). This multi-technique characterization provides insights into optimizing the fiber–matrix adhesion in these advanced thermoplastic composites. KW - Anionic Polyamide 6 KW - Reactive thermoplastics KW - Basalt fibers KW - Microdebonding KW - Fiber push out KW - Short beam shear test PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-623596 DO - https://doi.org/10.1016/j.compositesa.2024.108681 SN - 1878-5840 VL - 190 SP - 1 EP - 15 PB - Elsevier Ltd. CY - Niederlande AN - OPUS4-62359 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Cunningham, Patrick A1 - Wang, L. A1 - Kane, S. A1 - Kim, A. A1 - Jenkins, B. M. A1 - Miller, S. A. T1 - Lifecycle implications and mechanical properties of carbonated biomass ashes as carbon-storing supplementary cementitious materials N2 - Methods to sequester and store atmospheric CO2 are critical to combat climate change. Alkaline-rich bioashes are potential carbon fixing materials. This work investigates potential co-benefits from mineralizing carbon in biomass ashes and partially replacing high embodied greenhouse gas (GHG) Portland cement (PC) in cement-based materials with these ashes. Specifically, rice hull ash (RHA), wheat straw ash (WSA), and sugarcane bagasse ash (SBA) were treated to mineralize carbon, and their experimental carbon content was compared to modeled potential carbonation. To understand changes in the cement-based storage materials, mortars made with CO2-treated WSA and RHA were experimentally compared to PC-only mortars and mortars made with ashes without prior CO2 treatment. Life cycle assessment methodology was applied to understand potential reductions in GHG emissions. The modeled carbonation was ∼18 g-CO2/kg-RHA and ∼180 g-CO2/kg-WSA. Ashes oxidized at 500 °C had the largest measured carbon content (5.4 g-carbon/kg-RHA and 35.3 g-carbon/kg-WSA). This carbon appeared to be predominantly residual from the biomass. Isothermal calorimetry showed RHA-PC pastes had similar heat of hydration to PC-pastes, while WSA-PC pastes exhibited an early (at ∼1.5 min) endothermic dip. Mortars with 5 % and 15 % RHA replacement had 1–12 % higher compressive strength at 28 days than PC-only mortars, and milled WSA mortars with 5 % replacement had 3 % higher strength. A loss in strength was noted for the milled 15 % WSA, the CO2-treated 5 %, and the 15 % WSA mortars. Modeled reductions in GHG emissions from CO2-treated ashes were, however, marginal (<1 %) relative to the untreated ashes. KW - CO2 sequestration KW - CO2 storage KW - Biomass ash KW - Supplementary cementitious materials KW - Concrete PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-626959 DO - https://doi.org/10.1016/j.biombioe.2025.107772 SN - 1873-2909 VL - 197 SP - 1 EP - 13 PB - Elsevier CY - Amsterdam AN - OPUS4-62695 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Asante, Bright T1 - Optimized mix design and fire resistance of geopolymer recycled aggregate concrete under elevated temperatures N2 - This study investigates the performance of fly ash-based geopolymer recycled aggregate concrete (GRAC) as a sustainable alternative to Ordinary Portland Cement (OPC) concrete, focusing on its compressive strength and behavior under high-temperature exposure (150 ◦C, 300 ◦C, 600 ◦C, and 900 ◦C). The research emphasizes the use of 100 % recycled concrete aggregates as a replacement for natural aggregates, with samples cured at ambient conditions and at 60 ◦C in an oven. Key factors, including water content and curing conditions, were evaluated to determine their influence on compressive strength and thermal stability. Results indicate that water content is the primary factor governing compressive strength, while recycled aggregates contribute to a secondary but notable effect. GRAC maintained up to 65 % of its initial strength after exposure to 600 ◦C, though strength degradation and severe cracking occurred at 900 ◦C. Oven-cured samples showed fewer surface cracks but experienced slightly higher mass loss than room-cured coun-terparts. This study highlights the potential of GRAC as an environmentally friendly material capable of withstanding moderate thermal conditions, providing significant contributions to green construction practices and the reuse of construction and demolition waste. KW - Geopolymer KW - Recycled aggregate concrete KW - Elevated temperature PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-627071 DO - https://doi.org/10.1016/j.cscm.2025.e04401 SN - 2214-5095 VL - 22 SP - 1 EP - 17 PB - Elsevier Ltd. AN - OPUS4-62707 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Paul, Nathalie A1 - Kister, Alexander A1 - Schnellhardt, Thorben A1 - Fetz, Maximilian A1 - Hecker, Dirk A1 - Wirtz, Tim ED - Meo, Rosa ED - Silvestri, Fabrizio T1 - Reinforcement Learning for Segmented Manufacturing N2 - The manufacturing of large components is, in comparison to small components, cost intensive. This is due to the sheer size of the components and the limited scalability in number of produced items. To take advantage of the effects of small component production we segment the large components into smaller parts and schedule the production of these parts on regular-sized machine tools. We propose to apply and adapt recent developments in reinforcement learning in combination with heuristics to efficiently solve the resulting segmentation and assignment problem. In particular, we solve the assignment problem up to a factor of 8 faster and only a few percentages less accurate than a classic solver from operations research. T2 - European Conference on Machine Learning and Principles and Practice of Knowledge Discovery in Databases 2023 CY - Turin, Italy DA - 18.09.2023 KW - Reinforcement Learning KW - Assignment Problem KW - Large component manufacturing PY - 2025 DO - https://doi.org/10.1007/978-3-031-74640-6_38 VL - 1 IS - 1 SP - 470 EP - 485 PB - Springer Cham AN - OPUS4-63031 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Reigl, Selina A1 - Van Driessche, Alexander A1 - Stawski, Tomasz A1 - Koltzenburg, Sebastian A1 - Kunz, Werner A1 - Kellermeier, Matthias T1 - Sustainable Pathways for the Synthesis of Calcium Sulfate Hemihydrate N2 - Calcium sulfate, and especially its hemihydrate form (bassanite), is crucial in the construction industry, primarily used as a hydraulic binder in cements, mortars, and wallboards. Because of the rapid transformation of bassanite into thermodynamically stable gypsum (calcium sulfate dihydrate) upon contact with water, natural deposits are scarce, rendering it one of the most extensively produced inorganic materials worldwide. Currently, bassanite is derived from mined or waste gypsum through a thermal dehydration process, which is energy-intensive and costly. As sustainability has become a key target for industrial processes and products, a series of studies aiming to increase the energy efficiency and reduce the carbon footprint of bassanite production was published recently. Two primary approaches are pursued: conversion of gypsum and direct precipitation of bassanite from solution. In both cases, organic solvents, (specific) additives and/or elevated temperatures have been used to control the activity/availability of water in the reaction medium and thus direct phase selection towards bassanite. This review offers a comprehensive overview of alternative bassanite production methods, critically examining their benefits, potential downsides, and overall impact on the sustainability of industrial-scale use. KW - Calcium sulfate KW - Gypsum KW - Bassanite KW - Recycling PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-630657 DO - https://doi.org/10.1002/anie.202415161 SN - 1521-3773 SP - 1 EP - 20 PB - Wiley VHC-Verlag AN - OPUS4-63065 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Zöllner, Moritz T. A1 - Dariz, Petra A1 - Riedel, Jens A1 - Schmid, Thomas T1 - Dolomite and Mg Calcite as Mineral Thermometers in Mortar Binders. A High Resolution Raman Spectroscopic Study N2 - This paper suggests the use of high‐resolution Raman scattering bands of MgCa carbonates as posteriori thermometer minerals in archaeometric studies. Therefore, the thermal behavior of two dolomite samples and the hydration and carbonation reaction in air of the decomposition products were investigated by Raman microspectroscopy. The increase in the calcination temperature resulted in the formation of – Raman silent MgO and – inert Mg calcite at 700°C–750°C. In contrast, the decarbonation, hydration, and recarbonation of sample material exposed to 750°C–900°C in a muffle furnace led to the appearance of Mg‐free calcite. High spectral resolution Raman spectroscopy enabled a spectral distinction between these two groups due to differences in the band parameters (peak position, bandwidth) of the vibrational (v1, v4, L) modes of calcite. In combination with Raman microspectroscopic mapping, this spectral information represents a new approach for the estimation of burning temperatures of medieval high‐fired gypsum mortars via natural dolomite impurities. Thus, the results of this work highlight the importance and potential of Raman microspectroscopy as a thermometric tool for elucidating the thermal history of anthropogenic fired materials, with potential applications for archaeometry and art technology, as well as for quality controls in the frame of the production of mineral mortar binders and ceramics or bricks, respectively. KW - Mineral thermometry KW - Raman spectroscopy KW - Dolomite KW - High-fired gypsum mortar PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-630270 DO - https://doi.org/10.1002/jrs.6810 SN - 1097-4555 SP - 1 EP - 13 PB - Wiley AN - OPUS4-63027 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Liehr, Alexander A1 - Dingel, Kristina A1 - Kottke, Daniel A1 - Degener, Sebastian A1 - Meier, David A1 - Sick, Bernhard A1 - Niendorf, Thomas T1 - Data selection strategies for minimizing measurement time in materials characterization N2 - Every new material needs to be assessed and qualified for an envisaged application. A steadily increasing number of new alloys, designed to address challenges in terms of reliability and sustainability, poses significant demands on well-known analysis methods in terms of their efficiency, e.g., in X-ray diffraction analysis. Particularly in laboratory measurements, where the intensities in diffraction experiments tend to be low, a possibility to adapt the exposure time to the prevailing boundary conditions, i.e., the investigated microstructure, is seen to be a very effective approach. The counting time is decisive for, e.g., complex texture, phase, and residual stress measurements. Traditionally, more measurement points and, thus, longer data collection times lead to more accurate information. Here, too short counting times result in poor signal-to-background ratios and dominant signal noise, respectively, rendering subsequent evaluation more difficult or even impossible. Then, it is necessary to repeat experiments with adjusted, usually significantly longer counting time. To prevent redundant measurements, it is state-of-the-art to always consider the entire measurement range, regardless of whether the investigated points are relevant and contribute to the subsequent materials characterization, respectively. Obviously, this kind of approach is extremely time-consuming and, eventually, not efficient. The present study highlights that specific selection strategies, taking into account the prevailing microstructure of the alloy in focus, can decrease counting times in X-ray energy dispersive diffraction experiments without any detrimental effect on data quality for the subsequent analysis. All relevant data, including the code, are carefully assessed and will be the basis for a widely adapted strategy enabling efficient measurements not only in lab environments but also in large-scale facilities. KW - Materials characterization KW - Machine learning KW - X-ray diffraction KW - Measurement optimization PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-630831 DO - https://doi.org/10.1038/s41598-025-96221-1 SN - 2045-2322 VL - 15 IS - 1 SP - 1 EP - 12 PB - Springer Science and Business Media LLC AN - OPUS4-63083 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Strauß, Lea A1 - Duarte, Larissa A1 - Kruse, Julius A1 - Madia, Mauro A1 - Löwisch, Günther T1 - An equivalent stress approach for predicting fatigue behavior of additively manufactured AlSi10Mg N2 - Laser-based powder bed fusion (PBF-LB) is an advanced additive manufacturing technique renowned for its precision and capability to fabricate complex metal components. However, the high thermal gradients and rapid cooling rates intrinsic to this process introduce significant process-induced effects, such as inhomogeneities, surface roughness, anisotropy, and residual stress, all of which critically influence the fatigue behavior of the produced parts. This study investigates the fatigue performance of AlSi10Mg samples produced by PBF-LB, examining the impact of varying surface conditions, geometries, and residual stress levels. Fatigue-life prediction models are formulated based on nominal stress amplitude, residual stress, form factor, crack-initiating inhomogeneity, and surface roughness, with smooth samples serving as a baseline reference. The study presents two empirical models for predicting fatigue life and fatigue strength using S–N curves and the Kitagawa–Takahashi diagram with the El Haddad approach, derived from comprehensive experimental data, including finite element modeling, fatigue-life measurements, surface roughness evaluations, and residual stress analysis. KW - AlSi10Mg KW - Kitagawa–Takahashi diagram KW - El Haddad KW - Equivalent stress KW - Fatigue-life prediction KW - PBF-LB/M PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-625176 DO - https://doi.org/10.1007/s40964-025-00974-0 SP - 1 EP - 16 PB - Springer Science and Business Media LLC AN - OPUS4-62517 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Omar, Hassan A1 - Ahmadi, Shayan A1 - Szymoniak, Paulina A1 - Schönhals, Andreas T1 - Molecular Mobility of Thin Films of Poly (bisphenol-A carbonate) Capped and with one Free Surface: From Bulk-like Samples down to the Adsorbed Layer N2 - The molecular mobility of thin films of poly(bisphenol A carbonate) (PBAC) was systematically investigated using broadband dielectric spectroscopy, employing two distinct electrode configurations. First, films were prepared in a capped geometry between aluminum electrodes employing a crossed electrode capacitor (CEC) configuration, down to film thicknesses of 40 nm. The Vogel temperature, derived from the temperature dependence of relaxation rate of the α-relaxation, increases with decreasing film thickness characterized by an onset thickness. The onset thickness depends on the annealing conditions, with less intense annealing yielding a lower onset thickness. Additionally, a broadening of the β-relaxation peak was observed with decreasing thickness, attributed to the interaction of phenyl groups with thermally evaporated aluminum, resulting in a shift of certain relaxation modes to higher temperatures relative to the bulk material. A novel phenomenon, termed the slow Arrhenius process (SAP), was also identified in proximity to the α-relaxation temperature. For films with thicknesses below 40 nm, nanostructured electrodes (NSE) were utilized, incorporating nanostructured silica spacers to establish a free surface with air. This free surface causes an enhancement in the molecular mobility for the 40 nm sample, preserving the β-relaxation as a distinct peak. The α-relaxation was detectable in the dielectric loss down to 18 nm, shifting to higher temperatures as film thickness is decreased. Notably, the onset thickness for the increase in Vogel temperature was lower in the NSE configuration compared to the CEC setup, attributed to the presence of the polymer-air interface. KW - Thin polymer films PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-623422 DO - https://doi.org/10.1039/d4sm01238k SN - 1744-6848 VL - 21 IS - 2 SP - 241 EP - 254 PB - RSC AN - OPUS4-62342 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Liao, Chun-Man ED - Zhang, Jian T1 - Modal and Wave Propagation Analysis of Vibration Tests on a Laboratory Building Model Before and After Damage N2 - Weakened structural stiffness is often a consequence of building damage, particularly after severe events such as earthquakes, where compromised structural performance can pose significant risks. To prevent immediate structural failure, an early warning system is essential, which requires inspection of local components. This research aims to achieve that by exploring the wave propagation analysis method, specifically seismic interferometry. Previous studies have applied this method to building structures, treating them as homogeneous layers of grouped floors. By analyzing the wave travel time along the height of these layers, the fundamental period of the building was estimated. However, this approach did not account for local damage or the variability of structural components, similar to the limitations of vibration‐based damage detection methods, which mainly identify global changes. Thus, the goal of this paper is to improve structural health monitoring by examining the sensitivity of wave screening, bridging the gap between nondestructive testing and vibration‐based damage detection. A half‐scale, seven‐story building model, characterized by vertical stiffness irregularity and transverse plan asymmetry, was tested in a laboratory setting. Two vertical sensor arrays were placed near corner columns of different sizes, representing both strong and weak structural areas. These arrays recorded floor accelerations in three directions. The study confirmed the effectiveness of wave propagation analysis for detecting damage along the sensor arrays before and after the earthquake. A transmissibility damage indicator was used to correlate changes in wave velocity, providing a quantitative assessment of damage levels along the wave propagation path. KW - Damage location KW - Laboratory test KW - Soft story KW - Stifness irregular structure KW - Structural health monitoring PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-624931 DO - https://doi.org/10.1155/stc/3453150 SN - 1545-2263 VL - 2025 IS - 1 SP - 1 EP - 17 PB - John Wiley & Sons Ltd. AN - OPUS4-62493 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Nagel, Thomas A1 - Rühaak, Wolfram A1 - Amann, Florian A1 - Bracke, Guido A1 - Buske, Stefan A1 - Kowalski, Julia A1 - Reiche, Sönke A1 - Schäfer, Thorsten A1 - Scheytt, Traugott A1 - Stumpf, Thorsten A1 - Völzke, Holger A1 - Wellmann, Florian A1 - Kolditz, Olaf T1 - Deep geological disposal - Editorial to the topical collection N2 - The subsurface geological environment, historically a key source of fossil and mineral resources, has seen a significant broadening of its potential applications in recent years, with increasing emphasis on its use for energy production and storage. A critical factor in utilizing subsurface space is ensuring the sustainability of management practices, with particular attention to the potential environmental impacts that may result. The current Topical Collection on Deep Geological Disposal places greater emphasis on the geotechnical aspects of geological disposal, with a particular focus on the safe isolation of hazardous materials, including radioactive waste. The Topical Collection on Deep Geological Disposal covers both experimental (laboratory and in-situ) and theoretical studies of various geotechnical applications, such as geological disposal of radioactive or other materials, e.g. coal-based solid waste, carbon dioxide sequestration in fractured reservoirs, and brine solutions, but also aspects of uranium mining. The articles in the Topical Collections are arranged under the following headings: – Fundamental studies – Experimental studies – Numerical studies KW - Disposal KW - Radioactive Waste KW - Geology PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-624955 DO - https://doi.org/10.1007/s12665-024-12075-2 SN - 1866-6299 VL - 84 IS - 3 SP - 1 EP - 6 PB - Springer Nature AN - OPUS4-62495 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Fürst, Richard A1 - Häßler, Dustin A1 - Stelzner, Ludwig A1 - Hothan, Sascha T1 - Fire resistance of existing steel structures with aged intumescent coating based on an in situ test method N2 - Intumescent coatings are commonly used in civil engineering to increase the fire resistance of steel structures. Exposed to fire, the intumescent coating reacts and forms a thermal protective char around the steel member. Thus, the heating of the steel is significantly slowed down and the fire resistance can be improved. Information regarding the scope of application and the durability of intumescent coatings are given in national approvals or European Technical Assessment documents. Due to the environmental conditions, intumescent coatings are subjected to ageing effects, which can reduce the durability and their thermal protection performance. To predict the durability for several years, during the approval procedure the behaviour of intumescent coatings is predominantly extrapolated based on accelerated artificial ageing. The established German and European assessment procedures to test and assess durability assume a working life of at least 10 years. Additional evidence may be required for longer periods. However, at present there is no method of verifying the thermal performance of existing structural members on site. For this reason, BAM is conducting the research project "INSIST" [1] to develop a minimally invasive in situ test method to determine the fire resistance of existing steel structures with applied intumescent coating. The investigation includes the development of a mobile prototype furnace. The paper describes the test setup, the developed prototype furnace, and the results of the performed test programme on uncoated and coated steel specimens. Based on this, recommendations for the test procedure are given. KW - In situ testing KW - Fire resistance KW - Intumescent coating KW - Steel KW - Thermal protection KW - Durability PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-629533 DO - https://doi.org/10.1016/j.firesaf.2025.104380 VL - 153 SP - 1 EP - 12 PB - Elsevier Ltd. AN - OPUS4-62953 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Ferrier, Emmanuel A1 - Michel, Laurent A1 - Thiele, Marc A1 - Mercier, Julien T1 - Strain-rate effect on the bond strength of external bonded reinforced carbon fiber-reinforced polymer for concrete structure N2 - The aim of the presented study is to investigate the dynamic loading strength of an external bonded fiber-reinforced polymers (FRP) system under seismic loading. 16 bonded FRP samples under different loading speeds ranging as 0.0000167–0.8 m /s were examined to determine the characteristics of the FRP bond strength on the concrete. The mechanical tests involved measuring the concrete/FRP shear properties using a double-lap shear test. Sixteen concrete specimens were cast, strengthened and surface preparation, instrumented, and driven to failure in the LMC laboratory and the BAM laboratory (Germany). Dynamic loading increased the bonded strength mainly because of an increase in the concrete tensile strength. Experimental data are then analysed and competed with the equation given by the new European standard that develop the design of external bonded FRP. The characteristic properties and bonded strength obtained by design equation were compared. Based on the results design equation are modified. KW - EBR strengthening system KW - Desing bond strength KW - Durability PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-625354 DO - https://doi.org/10.1016/j.conbuildmat.2025.140216 SN - 1879-0526 VL - 466 SP - 1 EP - 14 PB - Elsevier Ltd. AN - OPUS4-62535 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Strangfeld, Christoph A1 - Müller-Vahl, H. F. A1 - Nayeri, C. N. A1 - Paschereit, C. O. A1 - Greenblatt, D. T1 - Airfoil synchronous surging and pitching N2 - Combined surging and pitching of an airfoil at the identical frequency (i.e. synchronously), at four different phase differences, was investigated theoretically and experimentally. The most general unsteady theoretical formulation was adopted to calculate the lift coefficient, and then extended to explicitly compute the unsteady bound vortex sheet. This was used for comparison with experiments and facilitated the computation of both Joukowsky and impulsive-pressure lift contributions. Experiments were performed using a symmetric 18 % thick airfoil in an unsteady wind tunnel at an average Reynolds number of 3.0*10^5 , with a free-stream oscillation amplitude of 51 %, an angle-of-attack range of 2° +- 2° and a reduced frequency of 0.097. In general, excellent correspondence was observed between theory and experiment, representing the first direct experimental validation of the general theory. It was shown, both theoretically and experimentally, that the lift coefficient was not accurately represented by independent superposition of surging and pitching effects, due to variations in the instantaneous effective reduced frequency not accounted for during pure pitching. Deviations from theory, observed at angle-of-attack phase leads of 90° and 180°, were attributed to bursting of separation bubbles during the early stages of the acceleration phase. The largest deviations occurred when the impulsive-pressure lift contribution was small relative to the Joukowsky contribution, because the latter was most affected by bubble bursting. Bubble bursting resulted in large form-drag oscillations that occurred at identical phase angles within the oscillation cycle, irrespective of the phase difference between surging and pitching, as well as in the absence of pitching. KW - Unsteady aerodynamics KW - Dynamic stall KW - Separation bubble KW - Bubble bursting PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-630068 DO - https://doi.org/10.1017/jfm.2025.220 SN - 1469-7645 VL - 1009 SP - 1 EP - 33 PB - Cambridge University Press (CUP) AN - OPUS4-63006 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Rosenbusch, Sjard Mathis A1 - Diercks, Philipp A1 - Kindrachuk, Vitaliy A1 - Unger, Jörg F. T1 - Integrating custom constitutive models into FEniCSx: A versatile approach and case studies N2 - The development and integration of user-defined constitutive relationships into finite element (FE) tools using standardized interfaces play a pivotal role in advancing the capabilities of FE solvers for structural mechanics applications. While commercial FE solvers like Abaqus and Ansys have designed their interfaces to provide custom stresses, tangents, and updated history variables, the open-source solver FEniCSx remains efficient only when the constitutive update has an analytical representation. This restricts the application of FEniCSx for non-linear structural mechanics. Since FEniCSx has become a powerful and popular open-source tool for solving partial differential equations, particularly due to its automatic computation of Hessians, we aim to develop a generalized interface to enhance its capability for constitutive modeling. This approach will address complex constitutive equations that require iterative solutions at the quadrature point level. Specific implementation challenges, such as using return-mapping procedures, can then be managed commonly. The provided interface for custom constitutive models offers a versatile way to implement them in various languages, including C++, Python, Rust, and Fortran. Finally, with UMATs for viscoplastic models as an example, we demonstrate how existing user subroutines can be incorporated into the interface and utilized within the FEniCSx framework. KW - Finite element method KW - Constitutive models KW - FEniCSx KW - UMAT KW - Rust KW - Python KW - C++ PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-630439 DO - https://doi.org/10.1016/j.advengsoft.2025.103922 SN - 0965-9978 VL - 206 SP - 1 EP - 11 PB - Elsevier CY - Amsterdam AN - OPUS4-63043 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Schwettmann-Lui, Kim A1 - Nytus, Nina A1 - Weigel, Sandra A1 - Radenberg, Martin A1 - Stephan, Dietmar T1 - Effect of multiple-repeated aging and rejuvenation processes on bitumen properties evaluated with physical and chemical tests and multivariate analysis methods N2 - This paper presents laboratory experiments on repeated bitumen aging and rejuvenation processes to assess multiple reuse feasibility. Three 50/70 penetration-graded bitumen samples were reused with four different rejuvenators without adding virgin binder. The experiments continued until significant material changes, such as inhomogeneities and increased stickiness, prevented reliable characterization. After each rejuvenation and aging process, physical and chemical properties were analyzed, resulting in a comprehensive dataset. Results indicate that the reuse of pure rejuvenators, without incorporating virgin binder, is limited. Cyclic reuse depends heavily on the rejuvenator and its interaction with the binder. Of the four rejuvenators tested, two bio-based products enabled the maximum reuse of four cycles. Therefore, the rejuvenators used in this project are more suitable as additives to improve the physical properties of the bitumen for reuse rather than as substitutes for the binder. The datasets were further evaluated using multivariate analysis methods to construct statistical models for two use cases: In the first use case, the samples are classified by their aging condition. In the second use case, the samples are differentiated according to the rejuvenators. The models were successfully validated, providing a promising framework for the classification of unknown bitumen samples for reuse. KW - Bitumen KW - Aging KW - Rejuvenation KW - Multiple recycling KW - DSR measurements KW - Reuse KW - FTIR spectroscopy KW - Multivariate analysis methods PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-627563 DO - https://doi.org/10.1016/j.conbuildmat.2025.140734 SN - 1879-0526 VL - 472 SP - 1 EP - 16 PB - Elsevier Ltd. AN - OPUS4-62756 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Capitain, C. A1 - Schüßler, M. A1 - Bugsel, B. A1 - Zweigle, J. A1 - Vogel, Christian A1 - Leube, Peter A1 - Zwiener, C. T1 - Implementation of matrix-matched semiquantification of PFAS in AFFF-contaminated soil N2 - This study presents a novel semiquantification approach for nontarget screening (NTS), combining matrix-matched calibration and ionization class-specific average calibration curves (ACCs) to address the lack of analytical reference standards for most per- and polyfluoroalkyl substances (PFAS). Ionization class-specific ACCs for carboxylic and sulfonic acids, sulfonamides, and cationic PFAS result in high accuracy, with median absolute accuracy quotients below 2.27×. The approach was applied to soil impacted by aqueous film-forming foam (AFFF) contamination. A total of 96 tentatively identified PFAS were semiquantified in addition to 28 quantified compounds based on available standards. Semiquantified concentrations exceeded those of target analytes, demonstrating the critical role of this method in capturing broader PFAS contamination. In this case, validation against extractable organofluorine (EOF) showed a 102% closed mass balance. The innovative approach not only enables comprehensive PFAS contamination assessment in complex matrices but also expands the scope of the NTS for environmental monitoring, remediation, and risk assessment of AFFF-contaminated sites. KW - Per- and polyfluoroalkyl substances (PFAS) KW - Contaminated soil KW - Non-targeted analysis KW - Combustion ion chromatography PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-629445 DO - https://doi.org/10.1021/acs.est.4c14255 SN - 1520-5851 VL - 59 IS - 14 SP - 7338 EP - 7347 PB - American Chemical Society (ACS) CY - Columbus, Ohio AN - OPUS4-62944 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - McGonigle, Rebecca A1 - Glasgow, Jodie A1 - Houston, Catriona A1 - Cameron, Iain A1 - Homann, Christian A1 - Black, Dominic J. A1 - Pal, Robert A1 - MacKenzie, Lewis E. ED - MacKenzie, Lewis E. T1 - Autoclave reactor synthesis of upconversion nanoparticles, unreported variables, and safety considerations N2 - Autoclave reactors are widely used across chemical and biological sciences, including for the synthesis of upconversion nanoparticles (UCNPs) and other nanomaterials. Yet, the details of how autoclave reactors are used in such synthesis are rarely reported in the literature, leaving several key synthesis variables widely unreported and thereby hampering experimental reproducibility. In this perspective, we discuss the safety considerations of autoclave reactors and note that autoclaves should only be used if they are (a) purchased from reputable suppliers/manufacturers and (b) have been certified compliant with relevant safety standards. Ultimately, using unsuitable autoclave equipment can pose a severe physical hazard and may breach legal safety requirements. In addition, we highlight several parameters in autoclave synthesis that should be reported as standard to maximise the reproducibility of autoclave synthesis experiments across materials and chemistry research. We encourage users of autoclave synthesis vessels to: (1) adopt high-safety autoclaves and (2) report the many experimental variables involved to enhance experimental reproducibility. KW - Reference material KW - Nano KW - Particle KW - Shell KW - Fluorescence KW - Lifetime KW - Decay kinetics KW - Synthesis KW - Quality assurance KW - Method KW - Energy transfer KW - Upconversion KW - Autoclave synthesis KW - Data comparability PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-625672 DO - https://doi.org/10.1038/s42004-025-01415-3 VL - 8 IS - 1 SP - 1 EP - 7 PB - Springer Science and Business Media LLC AN - OPUS4-62567 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Poka, Konstantin A1 - Ali, Sozol A1 - Saeed, Waleed A1 - Merz, Benjamin A1 - Epperlein, Martin A1 - Hilgenberg, Kai T1 - Quality assurance via a cyber physical system of a PBF-LB/M machine N2 - Powder Bed Fusion with Laser Beam of Metals (PBF-LB/M) faces challenges in reproducibility and quality assurance, even for widely applied alloys like AlSi10Mg. This work introduces a digital provenance framework for PBF-LB/M, showcased through the EOS M 300–4 multi-laser machine. An Extract, Transform, Load (ETL) pipeline autonomously captures machine data, including scan vectors as well as process signals, and organizes them into a Digital Shadow (DS). The DS is further extended by external data sources, such as Melt Pool Monitoring (MPM), to enable comprehensive analysis and root cause identification. This approach ensures continuous data representation and facilitates the development of new quality metrics. Moreover, the framework enhances quality assurance and traceability, supports compliance with industry standards, and improves productivity. It also enables more precise cost calculations and predictive maintenance. By addressing these challenges, the framework is essential for advancing PBF-LB/M in industrial applications, achieving greater consistency and scalability in production. KW - PBF-LB/M KW - Data driven quality assurance KW - Data engineering KW - Digital shadow PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-625187 DO - https://doi.org/10.1007/s40964-025-00978-w SN - 2363-9520 VL - 10 IS - 3 SP - 1771 EP - 1783 PB - Springer Science and Business Media LLC AN - OPUS4-62518 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Schackmann, Oliver A1 - Márquez Reyes, Octavio A. A1 - Memmolo, Vittorio A1 - Lozano, Daniel A1 - Prager, Jens A1 - Moll, Jochen A1 - Kraemer, Peter T1 - Machine learning strategies with ensemble voting for ultrasonic damage detection in composite structures under varying temperature or load conditions N2 - In recent years, the development of machine learning (ML) techniques has led to significant progress in the field of structural health monitoring with ultrasonic-guided waves. However, a number of challenges still need to be resolved for reliable operation in realistic settings. In this work, we consider the complex problem of experimental damage detection under varying temperature or load conditions where damage locations are not included in the training set. The ML techniques proposed here include supervised and unsupervised methods originally developed for image and time series classification combined with ensemble voting. A performance demonstration of the ML techniques is presented using benchmark datasets from the open-guided waves platform. The unsupervised approach is then applied to a new dataset from an experimental campaign carried out on a composite over-wrapped pressure vessel used for hydrogen storage with real defects. Results show that ensemble voting enables the effective combination of the predictions of multiple transducer pairs, even with a limited number of strong individual classifiers. When applied to unsupervised learning, this returns high accuracy also when real damage over the structure is considered. KW - Structural-Health-Monitoring KW - Ultrasonic guided waves PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-631571 DO - https://doi.org/10.1177/14759217251333066 SN - 1741-3168 SP - 1 EP - 19 PB - Sage Publications AN - OPUS4-63157 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Hendricks, A. A1 - Phillips, T. K. A1 - Engl, T. A1 - Plarre, Rudy A1 - Martinson, V. G. T1 - The bacterial microbiome in spider beetles and deathwatch beetles N2 - The beetle family Ptinidae contains a number of economically important pests, such as the cigarette beetle Lasioderma serricorne, the drugstore beetle Stegobium paniceum, and the diverse spider beetles. Many of these species are stored product pests, which target a diverse range of food sources, from dried tobacco to books made with organic materials. Despite the threat that the 2,200 species of Ptinidae beetles pose, fewer than 50 have been surveyed for microbial symbionts, and only a handful have been screened using contemporary genomic methods. In this study, we screen 116 individual specimens that cover most subfamilies of Ptinidae, with outgroup beetles from closely related families Dermestidae, Endecatomidae, and Bostrichidae. We used 16S ribosomal RNA gene amplicon data to characterize the bacterial microbiomes of these specimens. The majority of these species had never been screened for microbes. We found that, unlike in their sister family, Bostrichidae, that has two mutualistic bacteria seen in most species, there are no consistent bacterial members of ptinid microbiomes. For specimens which had Wolbachia infections, we did additional screening using multilocus sequence typing and showed that our populations have different strains of Wolbachia than noted in previous publications. KW - Sodalis KW - Ptinidae KW - Anobiidae KW - Bostrichidae KW - Dermestidae KW - Bostrichoidea KW - Wolbachia PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-631564 DO - https://doi.org/10.1128/spectrum.01981-24 SN - 2165-0497 VL - 13 IS - 5 SP - 1 EP - 14 AN - OPUS4-63156 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Amano, Kofi Owusu Ansah A1 - Tschirschwitz, Rico A1 - Gimadieva, Elena A1 - Köhler, Florian A1 - Krause, Ulrich T1 - Thermal runaway and explosibility of the gas release from 18650 sodium-ion cells of NFM chemistry N2 - The present study investigates the thermal runaway behaviour and explosibility of the gas mixture released from sodium-ion batteries (SIBs). A total of 30 tests comprising two test series were performed using 18650 SIBs with a NaNi1/3Fe1/3Mn1/3O2 (NFM) chemistry. The cells of SOC level = 0 %, 25 %, 50 %, 75 % and 100 % were subjected to thermal abuse inside a 10 L pressurized reaction vessel. In test series 1, the tests were performed in an air atmosphere. In test series 2, an inert atmosphere was used. First, the total amount of gas released from the SIBs was calculated based on the temperature and pressure measured in the reaction vessel. Subsequently, a gas composition analysis was performed using a Fourier-transformed infrared (FTIR) spectrometer. This study revealed that the thermal runaway in SIBs could be categorized into four phases. At the onset of thermal runaway, the thermal runaway-induced explosion of the cells resulted in a rate of temperature rise ranging from 2 K/s to 70 K/s. The investigation further revealed a peak reaction temperature of 415 ◦C and a maximum pressure of 4 bar could be reached at thermal runaway in the 10 L vessel. The gas release of up to 5 ± 0.3 L (4 ± 0.2 L/Ah, 1.3 ± 0.1 L/Wh) from test series 1 and 2.4 ± 0.2 L (2 ± 0.1 L/Ah, 0.53 ± 0.04 L/Wh) from test series 2 showed a dependence on SOC and failure environment used. By applying Le Chatelier's mixing rule, the measured gas release from the air atmosphere showed a calculated lower explosion limit and upper explosion limit values of 4.8 % and 24 % in volume fraction, respectively. KW - Sodium-ion battery KW - Thermal runaway KW - Gas release KW - Gas explosion KW - Explosion limit PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-631782 DO - https://doi.org/10.1016/j.est.2025.116614 SN - 2352-152X VL - 122 SP - 1 EP - 16 PB - Elsevier Ltd. AN - OPUS4-63178 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Jafari, Abbas A1 - Vlachas, K. A1 - Chatzi, E. A1 - Unger, Jörg F. T1 - A Bayesian framework for constitutive model identification via use of full field measurements, with application to heterogeneous materials N2 - In this paper, we present a Bayesian framework for the identification of the parameters of nonlinear constitutive material laws using full-field displacement measurements. The concept of force-based Finite Element Model Updating (FEMU-F) is employed, which relies on the availability of measurable quantities such as displacements and external forces. The proposed approach particularly unfolds the advantage of FEMU-F, as opposed to the conventional FEMU, by directly incorporating information from full-field measured displacements into the model. This feature is well-suited for heterogeneous materials with softening, where the localization zone depends on the random microstructure. Besides, to account for uncertainties in the measured displacements, we treat displacements as additional unknown variables to be identified, alongside the constitutive parameters. A variational Bayesian scheme is then employed to identify these unknowns via approximate posteriors under the assumption of multivariate normal distributions. An optimization problem is then formulated and solved iteratively, aiming to minimize the discrepancy between true and approximate posteriors. The benefit of the proposed approach lies in the stochastic nature of the formulation, which allows to tackle uncertainties related to model parameters and measurement noise. We verify the efficacy of our proposed framework on two simulated examples using gradient damage model with a path-dependent nonlinear constitutive law. Based on a nonlocal equivalent strain norm, this constitutive model can simulate a localized damage zone representing softening and cracking. The first example illustrates an application of the FEMU-F approach to cracked structures including sensitivity studies related to measurement noise and parameters of the prior distributions. In this example, the variational Bayesian solver demonstrates a sizable advantage in terms of computational efficiency compared to a traditional least-square optimizer. The second example demonstrates a sub-domain analysis to tackle challenges associated with limited domain knowledge such as uncertain boundary conditions. KW - Constitutive model identification KW - Full-field measurements KW - Variational Bayes KW - Force-based finite element model updating KW - FEMU-F PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-615476 DO - https://doi.org/10.1016/j.cma.2024.117489 SN - 1879-2138 VL - 433 IS - Part A SP - 1 EP - 32 PB - Elsevier B.V. AN - OPUS4-61547 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Pfennig, A. A1 - Simkin, Roman T1 - Identifying the initial corrosion fatigue failure based on dropping electrochemical potential N2 - The corrosion fatigue of duplex stainless-steel X2CrNiMoN22-5-3 can be determined by purely alternating axial cyclic load to failure using hour-glass shaped specimens. The experimental setup comprises a corrosion chamber allowing for the circulation of an aquifer electrolyte heated to 369 K simulating a carbon capture and storage as well as geothermal power plant environment. During engineering of a carbon storage site or geothermal power plant, it may be crucial to determine the failure onset of a component beforehand. Therefore, an algorithm with 93.3% reliability was established based on splitting the measured potential values into ten time series with a capacity of ten values. The failure of corrosion fatigue specimens in a geothermal environment correlates to the drop of the curves of the electrochemical potential which is measured simultaneously within the corrosion chamber. Crack initiation was, therefore, successfully derived from the electrochemical potential. KW - Corrosion fatigue KW - Surface corrosion KW - CO2 KW - Crack initiation KW - Geothermal energy production PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-629310 DO - https://doi.org/10.3390/app15010403 SN - 2076-3417 VL - 15 IS - 1 SP - 1 EP - 15 PB - MDPI CY - Basel AN - OPUS4-62931 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Kumar, Sumit A1 - Swaminathan, Srinivasan A1 - Hesse, Rene A1 - Goldbeck, Hennig A1 - Ding, Wenjin A1 - Bonk, Alexander A1 - Bauer, Thomas T1 - Understanding the effect of oxide ions on Solar Salt chemistry and corrosion mechanism of 316L stainless steel at 600 °C N2 - Solar Salt (60 wt% NaNO3, 40 wt% KNO3), used in Concentrated Solar Power (CSP) Thermal Energy Storage (TES) technology, can decompose into various products at elevated temperatures, with oxide ions being one of the known corrosive byproducts. The study mimics Solar Salt aging by intentionally adding sodium peroxide (Na2O2) and sodium oxide (Na2O) at concentrations of 0.005–0.33 wt% to investigate their role in the corrosion of austenitic stainless steel at 600 °C in typical operating conditions. Salt chemistry (nitrite, nitrate, oxide ions, and metal cations) was analyzed every 24 h, and steel corrosion after 168 h was assessed by weight change, corrosion rate, phase analysis, and cross-sectional morphology. Results reveal that at or above 0.135 wt% added Na2O2/Na2O leads to a quasi-steady-state equilibrium of oxide ions in the salt. Interestingly, at these concentrations, the presence of steel further decreases oxide ion concentration. Furthermore, above 0.135 wt%, the corrosion rate increases significantly, along with increased spallation, porosity and disintegration of the corrosion layer, forming a non-protective layer. This study highlights the critical role of oxide ions in the corrosion process. KW - Solar Salt KW - High temperature corrosion KW - Thermal Energy Storage KW - Alkali oxides KW - Austenitic stainless steel PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-628463 DO - https://doi.org/10.1016/j.corsci.2025.112849 SN - 1879-0496 VL - 249 SP - 1 EP - 17 PB - Elsevier Ltd. AN - OPUS4-62846 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - John, Elisabeth A1 - Jakob, Cordula A1 - Pott, Ursula A1 - Sando, Mona T1 - Repeatability and reproducibility challenges of isothermal heat flow calorimetry with in situ mixing N2 - Isothermal heat flow calorimetry evaluates heat development during binder reactions. It distinguishes between in situ calorimetry, where mixing occurs within the device, and ex situ calorimetry, involving externally mixed samples. Despite ex situ calorimetry being a standard method in binder research, in situ calorimetry is underutilized. This paper aims to promote its adoption by summarizing challenges related to repeatability and reproducibility and offering solutions. The initial section addresses repeatability issues caused by preventable errors, providing a structured guide for experimental design. It was found that water leakage had minimal impact, and sample size is crucial for data robustness. The second section examines operational challenges, revealing that frictional heating, affecting recorded heat, can be minimized with an optimized mixing protocol. The final part highlights that significant errors in measured data stem from signal delay and heat loss, offering methods to correct these issues for improved reproducibility in in situ calorimetric experiments. KW - In situ calorimetry PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-628431 DO - https://doi.org/10.1016/j.cemconres.2025.107872 SN - 1873-3948 VL - 194 SP - 1 EP - 11 PB - Elsevier Ltd. AN - OPUS4-62843 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Baeßler, Matthias A1 - Simon, Patrick T1 - Ballasted track on vibrating bridge decks: physical mechanisms, empirical findings, and a proposal for assessment N2 - This paper summarizes the key findings and physical mechanisms and provides information on open questions and the assessment of railway bridge superstructure vibrations. Bridges are classic disruption points on a railway track. If bridge superstructures are dynamically excited by train traffic, the vertical accelerations of the track must be considered. For a ballasted track, this can lead to the destabilization of the ballast track, as the bridge superstructure acts like a vibrating table. In this respect, the paper explains in more detail what is meant by destabilization, when this destabilization occurs and how various influencing parameters such as acceleration amplitude, the vibration sequence and frequency affect its occurrence. In the InBridge4EU project, gaps in knowledge such as the effect of single impulse loads are being investigated experimentally. A new test facility has been set up for this purpose, the initial results of which are presented here. An essential element in the assessment of this scenario is the stability of the track under high compression forces with simultaneous dynamic excitation of the superstructure. A new approach for the assessment of bridge vibrations with respect to lateral stability is presented. KW - Railway bridge dynamics KW - Bridge deck acceleration KW - Ballast destabilization KW - Lateral track stability KW - Track buckling PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-630972 DO - https://doi.org/10.1142/S0219455425400243 SN - 0219-4554 SN - 1793-6764 IS - 2540024 SP - 1 EP - 27 PB - World Scientific CY - Singapore AN - OPUS4-63097 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Willms, Thomas A1 - Kryk, Holger A1 - Hampel, Uwe T1 - An improved method for the analysis of the reaction products of the partial isobutane oxidation by gas chromatography using a green solvent N2 - In the present work, an improved GC/MS method for the analysis of the reaction products of the non-catalytic partial oxidation of isobutane at a starting temperature of 25°C has been developed and compared to a previously published method. Two green GC-solvents (dimethyl carbonate (DMC), diethyl carbonate (DEC)) and several internal standards (hexane, benzene, toluene, DEC) have been tested. The separation of the products at low retention times (methanol, isobutane, isobutene) could be significantly improved. For the liquid main products t-butyl hydroperoxide (TBHP), di-t-butyl peroxide (DTBP), t-butanol (TBA), propanone and most trace products (isopropanol, isobutanal, methyl formate, isopropyl formate, t-butyl formate and some acetates – 24 compounds in total), a coefficient of determination CoD > 0.999 has been achieved. For all weighing and GC/MS measurements uncertainties have been calculated. The peaks of the peak pair t-butyl formate (CoD >0.999) and isobutanol (CoD >0.99), have been simulated and used for calibrations. DEC gave a decomposition of TBHP on the column. With DMC, a problem of peak purity of TBHP appeared but could be resolved. The use of the green solvent DMC, compared to also studied traditional solvents like heptane and toluene, proved to be very beneficial, since it also permitted to determine polar compounds, e. g. carbon dioxide and formic acid. KW - GC/MS KW - Green solvent KW - Method development KW - Peroxide KW - Measurement uncertainties KW - Oxidation products KW - Simulation PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-632026 DO - https://doi.org/10.1016/j.chroma.2025.465892 SN - 0021-9673 VL - 1753 SP - 1 EP - 16 PB - Elsevier CY - Amsterdam AN - OPUS4-63202 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Xu, Q. A1 - Szymoniak, Paulina A1 - Kolmangadi, Mohamed A. A1 - Yang, Z. A1 - Wang, S. A1 - Gao, Y. A1 - Shang, J. A1 - Hunger, J. A1 - Aldiyarov, A. A1 - Schönhals, Andreas A1 - Ge, Y. A1 - Qi, Z. T1 - Molecular engineering of supramolecular polymer adhesive with confined water and a single crown ether N2 - Here, we report a water-induced supramolecular polymer built from confined structural water and an intrinsic amphiphilic macrocyclic self-assembly in a nanophase separated structure. The newly designed crown ether macrocycle, featuring strong hydrophilic hydrogen bonding receptor selenoxide and a synergistical hydrophobic selenium-substituted crown core, confines the structural water in a segregated, interdigitated architecture. Although water molecules typically freeze around 0 °C, the confined structural water in this supramolecular polymer remains in a liquid-like state down to 80 °C. Previous studies suggest that multiple crown ether units are needed to generate structural water. However, here, one unit is sufficient to control the formation and disappearance of structural water and consequent supramolecular polymerization. Typically, the DC conductivity of water shows Arrhenius temperature dependency (lnσDC ∝ 1/T). In contrast, this new crown unit maintains water in confined states, which exhibit a Vogel/Fulcher/Tammann behavior (lnσDC ∝ 1/(T-T0)) at temperatures above the glass transition temperature. Moreover, this water-induced supramolecular polymer exhibits remarkable adhesion properties to hydrophilic surfaces and maintains tough adhesion at low temperatures. These findings show how a single small macrocycle can govern the complex structure and functionality of water in supramolecular systems. KW - Supramolecular polymerization PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-623631 DO - https://doi.org/10.1039/D4SC06771A SN - 2041-6539 VL - 16 SP - 1 EP - 9 PB - RSC AN - OPUS4-62363 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Nandish, Ranjith A1 - Knaust, Christian A1 - Zehfuß, Jochen T1 - Numerical Investigations of a Large Fire Exposure Crib Test—Presenting Different Pyrolysis Modelling Methodologies and Numerical Results N2 - ABSTRACTThe need for numerical‐based approaches to investigate the fire behaviour in buildings with combustible components is growing due to the increasing use of timber by the construction industry to meet the ‘Climate Action Plan 2050’. This requires consideration of the complex kinetic processes that take place during the burning of the wood in the numerical models. This is accomplished by using computational fluid dynamics (CFD) to numerically model the material pyrolysis and combustion processes. This article presents three different approaches for simulating the behaviour of a wood crib fire using the fire dynamics simulator (FDS). These approaches are based on either prescribing the burning rate of the wood directly from the physical experiments or using the kinetic parameters to govern the underlying processes, such as pyrolysis. Wooden crib fire experiments carried out by the RISE Research Institute in Sweden inside the combustion chamber that were used to validate all the methods. The numerical results from the method, that utilised the experimentally determined burning rate, were in good agreement with the experimental results, with a maximum deviation of 6% in the case of HRR. On the other hand, the model that needs kinetic parameters as its input has shown maximum discrepancies of 12% and 33% compared to experimental results. These methods are sensitive to the input parameters and the extent of dependency needs further investigation. KW - Pyrolysis KW - Wood combustion KW - Wood fire loads KW - Wooden buildings PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-626567 DO - https://doi.org/10.1002/fam.3287 SN - 1099-1018 VL - 49 IS - 4 SP - 371 EP - 387 PB - John Wiley & Sons Ltd. AN - OPUS4-62656 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Zhu, Jiangchao A1 - Madia, Mauro A1 - Schurig, Michael A1 - Kruse, Julius A1 - Conrad, Fabian A1 - Schlums, Hartmut A1 - Kontermann, Christian A1 - Zerbst, Uwe T1 - On the use of representative specimens for the structural integrity assessment of safety-relevant rotating components N2 - Safety-relevant components, for which a failure in service could have catastrophic consequences, are usually designed for extremely low probability of failure and they are subjected to stringent part qualification procedures according to guidelines set by regulatory agencies. Manufacturers are often forced to perform tests on full scale or scaled components to ensure the structural integrity under defined loading conditions, which usually implies a huge experimental and financial effort. Therefore, companies try to develop new strategies such as digital twins, which allow to massively reduce costs, without compromising safety. This work presents a new quasi-static testing and assessment concept, the main idea of which is to replace, or at least reduce, the experimental testing on components by testing specimens representative of the component. Fracture mechanics specimens have been designed iteratively by numerical simulations to match the stress state at the crack-tip of the maximum permissible defect defined by regulatory agencies for the component. Potentially, the major benefit of the proposed approach is that the tests can be performed on conventional laboratory testing machines. The effectiveness of the methodology is demonstrated in case of the structural integrity assessment of a Ni-base superalloy aero-engine turbine disk at overspeed conditions. KW - Structural integrity KW - Turbine disk KW - Burst KW - Fracture mechanics KW - Representative specimens KW - Quasi-static testing PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-624208 DO - https://doi.org/10.1016/j.engfracmech.2024.110710 SN - 0013-7944 VL - 314 SP - 1 EP - 23 PB - Elsevier Ltd. AN - OPUS4-62420 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Martin, T. A1 - Zimmermann, E. A1 - Klitzsch, N. A1 - Hördt, A. A1 - Huisman, J. A. A1 - Radic, T. A1 - Kruschwitz, Sabine T1 - Round-robin test of SIP laboratory measurements using electrical test networks N2 - This study presents the results of an interlaboratory test designed to evaluate the accuracy of spectral induced polarization (SIP) measurements using controlled electrical test networks. The study, conducted in Germany since 2006, involved 12 research institutes, six different impedance measurement devices and four types of electrical test networks specifically designed to evaluate phase shift errors in SIP measurements. The test networks, with impedances ranging from 100 to 150 kΩ, represent high-impedance samples with different phase characteristics, and pose the measurement challenges typical of such samples, including high contact impedances and parasitic capacitances. Four key findings emerged from the study: (1) Impedance measurements across all devices showed deviations within 1 per cent over a wide frequency range (0.001–1000 Hz); (2) phase errors remained below 1 mrad up to 100 Hz for most devices, but increased at higher frequencies due to parasitic capacitances and electromagnetic coupling effects; (3) lab-specific instruments have lower phase errors than field instruments when used in a laboratory environment, primarily due to the effects of long cables and too low input impedances of the field instruments; and (4) short cables and driven shielding technology effectively minimized parasitic capacitance and improved measurement accuracy. The study highlights the usefulness of test networks in assessing the accuracy of SIP measurements and raises awareness of the various factors influencing the quality of SIP data. KW - Induced polarization KW - Electrical properties KW - Electrical resistivity tomography (ERT) PY - 2025 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-631522 DO - https://doi.org/10.1093/gji/ggaf153 SN - 0956-540X VL - 242 IS - 1 SP - 1 EP - 13 PB - Oxford University Press (OUP) AN - OPUS4-63152 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER -