TY - JOUR A1 - Jacobson, David A1 - Darvishi Kamachali, Reza A1 - Thompson, Gregory T1 - Coupling density phase field models with atomistic potentials N2 - A density-based phase field model is developed where the free energy functional is explicitly linked with molecular dynamics and is referred to as the Molecular Phase Field Method (MoPF). MoPF simulations involve expressing interatomic potentials in terms of density to form a density based free energy functional. Inputs to this functional are taken from atomistics such that the phase field density profile matches the corresponding density profile from atomistic simulations. We analyze our results by comparing the MoPF calculated excess interfacial energies with excess interfacial energies calculated using molecular dynamics associated with several nickel grain boundaries. Additionally, a comparison is made between our results and the interfacial energies of a \Sigma7 boundary across a variety of FCC systems simulated using density functional theory. The MoPF method is able to successfully predict grain boundary free energy trends between grain boundary and material types offering an atomistically informed mesoscale formulation for studying grain boundary physics. KW - Density-based Phase-Field Modelling KW - Atomistic Simulation KW - Grain Boundary PY - 2024 DO - https://doi.org/10.1016/j.commatsci.2023.112763 VL - 233 SP - 1 EP - 6 PB - Elsevier AN - OPUS4-59360 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Schröder, Jakob A1 - Heldmann, Alexander A1 - Hofmann, Michael A1 - Evans, Alexander A1 - Petry, Winfried A1 - Bruno, Giovanni T1 - Diffraction and Single-Crystal Elastic Constants of Laser Powder Bed Fused Inconel 718 N2 - In this presentation, the results of the determination of the diffraction and single-crystal elastic constants of laser powder bed fused Inconel 718 are presented. The analysis is based on high-energy synchrotron diffraction experiments performed at the Deutsches Elektronen-Synchrotron. It is shown that the characteristic microstructure of laser powder bed fused Inconel 718 impacts the elastic anisotropy and therefore the diffraction and single-crystal elastic constants. Finally, the consequences on the diffraction-based residual stress determination of laser powder bed fused Inconel 718 are discussed. T2 - AWT-Fachausschuss 13 "Eigenspannungen" CY - Wolfsburg, Germany DA - 19.03.2024 KW - Additive Manufacturing KW - Laser Powder Bed fusion KW - Diffraction KW - In-Situ Testing KW - Diffraction Elastic Constants PY - 2024 AN - OPUS4-59900 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - GEN A1 - Beygi Nasrabadi, Hossein A1 - Bauer, Felix A1 - Uhlemann, Patrick A1 - Rehmer, Birgit A1 - Skrotzki, Birgit T1 - KupferDigital mechanical testing datasets: Stress relaxation and low-cycle fatigue (LCF) tests N2 - The KupferDigital project deals with the development of a data ecosystem for digital materials research on the basis of ontology-based digital representations of copper and copper alloys. This document provides exemplary mechanical testing datasets for training the developed KupferDigital infrastructures. Different types of cast copper alloys were provided for this research and their mechanical testing (stress relaxation and low-cycle fatigue) was performed in the accredited materials testing laboratory, while the test results were reported according to the DIN/ISO standards and attached with the maximum possible metadata about the sample history, equipment, and calibration. The attached content file consisted of the obtained primary raw testing data as well as the secondary datasets of these tests containing the detailed metadata of mechanical testing methods. Such test data files are processed by the KupferDigital digital tools to be converted to standardized machine-readable data files. KW - Copper alloys KW - Dataset KW - Stress relaxation KW - Mechanical testing KW - Low-cycle fatigue. PY - 2024 DO - https://doi.org/10.5281/zenodo.10820437 PB - Zenodo CY - Geneva AN - OPUS4-59665 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Schilling, Markus A1 - Bayerlein, Bernd A1 - Waitelonis, J. A1 - Birkholz, H. A1 - v. Hartrott, P. A1 - Portella, Pedro Dolabella T1 - FAIR Data in Platform MaterialDigital (PMD) - Ontologies , Semantic Data Integration and Data Exchange N2 - Following the new paradigm of materials development, design, and optimization, digitalization is the main goal in materials sciences and engineering (MSE) which imposes a huge challenge. In this respect, the quality assurance of processes and output data as well as the interoperability between applications following FAIR principles are to be ensured. For storage, processing, and querying of data in contextualized form, Semantic Web technologies (SWT) are used since they allow for machine-actionable and human-readable knowledge representations needed for data management, retrieval, and (re)use. The project ‘platform MaterialDigital’ (PMD, https://materialdigital.de) aims to bring together and support interested parties from both industrial and academic sectors in a sustainable manner in solving digitalization tasks and implementing digital solutions. Therefore, the establishment of a virtual material data space and the systematization of the handling of hierarchical, process-dependent material data are focused. Core points to be dealt with are the development of agreements on data structures and interfaces implemented in distinct software tools and to offer users specific support in their projects. Furthermore, the platform contributes to a standardized description of data processing methods in materials research. In this respect, selected MSE methods are semantically represented which are supposed to serve as best practice examples with respect to knowledge representation and the creation of knowledge graphs used for material data. Accordingly, this presentation shows the efforts taken within the PMD project towards the digitalization in MSE such as the development of the mid-level PMD core ontology (PMDco, https://github.com/materialdigital/core-ontology). Furthermore, selected results of a PMD partner project use case addressing data and knowledge management from synthesis, production, and characterization of materials are shown. T2 - 1st VMAP User Meeting 2024 CY - Sankt Augustin, Germany DA - 14.02.2024 KW - Ontology KW - Semantic Web Technologies KW - Plattform MaterialDigital KW - Data Interoperability KW - Data Exchange KW - Data Structures PY - 2024 AN - OPUS4-59567 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Schilling, Markus A1 - Bayerlein, Bernd A1 - von Hartrott, Philipp A1 - Waitelonis, Jörg A1 - Birkholz, Henk A1 - Portella, Pedro Dolabella A1 - Skrotzki, Birgit T1 - FAIR and Structured Data: A Domain Ontology Aligned with Standard‐Compliant Tensile Testing N2 - The digitalization of materials science and engineering (MSE) is currently leading to remarkable advancements in materials research, design, and optimization, fueled by computer‐driven simulations, artificial intelligence, and machine learning. While these developments promise to accelerate materials innovation, challenges in quality assurance, data interoperability, and data management have to be addressed. In response, the adoption of semantic web technologies has emerged as a powerful solution in MSE. Ontologies provide structured and machine‐actionable knowledge representations that enable data integration, harmonization, and improved research collaboration. This study focuses on the tensile test ontology (TTO), which semantically represents the mechanical tensile test method and is developed within the project Plattform MaterialDigital (PMD) in connection with the PMD Core Ontology. Based on ISO 6892‐1, the test standard‐compliant TTO offers a structured vocabulary for tensile test data, ensuring data interoperability, transparency, and reproducibility. By categorizing measurement data and metadata, it facilitates comprehensive data analysis, interpretation, and systematic search in databases. The path from developing an ontology in accordance with an associated test standard, converting selected tensile test data into the interoperable resource description framework format, up to connecting the ontology and data is presented. Such a semantic connection using a data mapping procedure leads to an enhanced ability of querying. The TTO provides a valuable resource for materials researchers and engineers, promoting data and metadata standardization and sharing. Its usage ensures the generation of finable, accessible, interoperable, and reusable data while maintaining both human and machine actionability. KW - Data Interoperability KW - Domain Ontology Development KW - FAIR Data Management KW - Knowledge Representation KW - Tensile Test Ontology KW - Semantic Web Technologies PY - 2024 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-598142 DO - https://doi.org/10.1002/adem.202400138 SN - 1438-1656 SP - 1 EP - 19 PB - Wiley VHC-Verlag AN - OPUS4-59814 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Bhadeliya, Ashok A1 - Rehmer, Birgit A1 - Fedelich, Bernard A1 - Skrotzki, Birgit A1 - Olbricht, Jürgen T1 - High temperature fatigue crack growth in nickel-based alloys joined by brazing and additive manufacturing N2 - Gas turbine components, made of nickel-based alloys, undergo material damage due to high temperatures and mechanical stresses. These components need periodic replacement to avoid efficiency loss and failure. Repair of these parts is more cost-effective than replacement. State-of-the-art repair technologies, including different additive manufacturing (AM) and brazing processes, are considered for efficient restoration. Materials properties mismatches and/or internal defects in repaired parts may expedite crack initiation and propagation, reducing fatigue life. To understand the crack growth behavior in joining zones and predict the remaining life of repaired components, fatigue crack growth (FCG) tests were conducted on specimens of nickel-based alloys joined via brazing, pre-sintered preforms and AM. The FCG experimental technique was successfully adapted for joined specimens and results indicate that the investigated braze material provides a lower resistance to crack growth. In AM-sandwich specimens, the crack growth rates are significantly reduced at the interface of AM and cast material. T2 - TMS 2024 Annual Meeting & Exhibition CY - Orlando, Florida, USA DA - 03.03.2024 KW - Fatigue crack growth KW - Joined nickel-based alloys PY - 2024 AN - OPUS4-59854 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Prabhakara, Prathik A1 - Heckel, Thomas A1 - Gohlke, Dirk A1 - Brackrock, Daniel A1 - Manzoni, Anna T1 - Ein synergistischer Ansatz zur Charakterisierung anisotroper Materialien mit Hilfe von Ultraschall und Mikrostrukturanalyse N2 - Es wird eine Studie zur Charakterisierung eines anisotropen Stahls vorgestellt, bei der Ultraschalluntersuchungen mit Mikrostrukturanalysen verbunden werden. Das Material weist hohe Festigkeit und Korrosionsbeständigkeit auf, zugleich ist mit anisotropen Eigenschaften die mechanischen und betrieblichen Eigenschaften beeinflussen zu rechnen. Vorläufige Ergebnisse lassen vermuten, dass weitere Untersuchungen notwendig sind, um die Fähigkeiten und Grenzen des Materials genau zu bestimmen. Es wird ein systematischer Ansatz mit Array- Prüfköpfen, Time-of-Flight Diffraction (TOFD) Technik und mikrostrukturellen Untersuchungen angewendet, um die Wechselwirkung zwischen Anisotropie und Mikrostruktur des Stahls zu analysieren. Ultraschallprüfungen mit der TOFD-Technik und in Tauchtechnik liefern Einblicke in das anisotrope Verhalten des Werkstoffes, einschließlich entsprechenden Kornorientierung, Dämpfung und Schallgeschwindigkeitsvariation. Diese Messungen führen in Verbindung mit mikrostrukturellen Analysen zu einem tieferen Verständnis des Materialverhaltens. Unser Hauptziel ist es, ein Framework zu erstellen, welches die Ultraschallantwort anisotroper Materialien mit ihren mikroskopischen Struktureigenschaften verbindet. Die vorgestellte Methodik ermöglicht eine zerstörungsfreie und zügige Bewertung der Materialintegrität, was besonders bei der Anwendung von Hochleistungsmaterialien relevant ist. Durch diesen integrativen Ansatz werden verschiedener Charakterisierungsmethoden kombiniert, um ein umfassenderes Materialverständnis zu erreichen. T2 - DGZfP-Jahrestagung 2024 CY - Osnabrück, Germany DA - 06.05.2024 KW - Ultrasonic Testing KW - Time-offlight Diffraction (TOFD) KW - Microstructure Analysis KW - Non-Destructive Testing PY - 2024 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-600122 UR - https://www.ndt.net/?id=29535 AN - OPUS4-60012 LA - deu AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Hoffmann, Moritz A1 - Stawarczyk, Bogna A1 - Günster, Jens A1 - Zocca, Andrea T1 - Influence of additives and binder on the physical properties of dental silicate glass-ceramic feedstock for additive manufacturing N2 - Objectives The aim of the study was to investigate the impact of organic additives (binder, plasticizer, and the cross-linking ink) in the formulation of water-based feedstocks on the properties of a dental feldspathic glass-ceramic material developed for the slurry-based additive manufacturing technology “LSD-print.” Material and methods Three water-based feldspathic feedstocks were produced to study the effects of polyvinyl alcohol (AC1) and poly (sodium 4-styrenesulfonate) (AC2) as binder systems. A feedstock without organic additives was tested as the control group (CG). Disc-shaped (n = 15) and bar (n = 7) specimens were slip-cast and characterized in the green and fired states. In the green state, density and flexural strength were measured. In the fired state, density, shrinkage, flexural strength (FS), Weibull modulus, fracture toughness (KIC), Martens parameters, and microstructure were analyzed. Disc-shaped and bar specimens were also cut from commercially available CAD/CAM blocks and used as a target reference (TR) for the fired state. Results In the green state, CG showed the highest bulk density but the lowest FS, while the highest FS in the green state was achieved with the addition of a cross-linking ink. After firing, no significant differences in density and a similar microstructure were observed for all slip-cast groups, indicating that almost complete densification could be achieved. The CAD/CAM specimens showed the highest mean FS, Weibull modulus, and KIC, with significant differences between some of the slip-cast groups. Significance These results suggest that the investigated feedstocks are promising candidates for the slurry-based additive manufacturing of restorations meeting the class 1a requirements according to DIN EN ISO 6871:2019–01. KW - Firing KW - 3D-printing KW - Silicate glass-ceramics KW - Debinding PY - 2024 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-600516 DO - https://doi.org/10.1016/j.jmbbm.2024.106563 SN - 1751-6161 VL - 155 SP - 1 EP - 12 PB - Elsevier B.V. AN - OPUS4-60051 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Zocca, Andrea A1 - Mühler, T. A1 - Günster, Jens T1 - LSD-print: a 10-years journey of an additive manufacturing technology from porcelain to technical ceramics N2 - Motivated by the aim of developing an additive manufacturing (AM) technology easily integrated in the process chains of the ceramic industry, the LSD-print technology was conceived as a slurry-based variation of binder jetting (BJ). BJ and other powder bed technologies (such as powder bed fusion) are amongst the most successful AM techniques, especially for metals and polymers, thanks to their high productivity and scalability. The possibility to use commercially available feedstocks (in the form of powders or granules) makes BJ also attractive for ceramic materials. The application of these techniques to most advanced ceramics has however been difficult so far, because of the limitations in depositing homogeneous layers with fine, typically poorly flowable powders. In this context, the "layerwise slurry deposition" (LSD) was proposed at TU Clausthal (Germany) as a slurry-based deposition of ceramic layers by means of a doctor blade. Combined with layer-by-layer laser sintering of the material, the LSD process was originally demonstrated for the rapid prototyping of silicate ceramics. Due to the difficulties in controlling the microstructure and the defect formation in laser-sintered technical ceramics, the LSD process was later combined with inkjet printing in the LSD-print technology, which has been further developed at BAM (Germany) in the past decade. The LSD-print technology combines the high speed of inkjet printing, typical of BJ, with the possibility of producing a variety of high-quality ceramics with properties comparable to those achieved by traditional processing. Due to the mechanical stability of the powder bed, the process can also be carried out with continuous layer deposition on a rotating platform, which further increases its productivity. This presentation will delve into 10 years of research on the LSD-print of a wide variety of technical ceramics including alumina, silicon carbides and dental ceramics. The discussion highlights how a seemingly small process and feedstock modification (from powders to slurries) has great influence on the challenges and potential of this process, which are being addressed on its path to industrialization. T2 - young Ceramists Additive Manufacturing Forum (yCAM) 2024 CY - Tampere, Finland DA - 06.05.2024 KW - Additive Manufacturing KW - Ceramic KW - Layerwise slurry deposition KW - Slurry KW - LSD-print PY - 2024 AN - OPUS4-60056 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Zocca, Andrea A1 - Mühler, T. A1 - Schubert, Hendrik A1 - Günster, Jens T1 - Water-based additive manufacturing of ceramics by Laser-Induced Slip Casting (LIS) N2 - The Laser-Induced Slip Casting is an additive manufacturing technology specifically developed for ceramic materials using water-based ceramic slurries. The process takes place layer-by-layer in a similar fashion as top-down vat photopolymerization, selectively consolidating each layer by means of a laser energy source positioned on the top. Contrary to vat photopolymerization, in which the consolidation is achieved by selectively cross-linking a ceramic-filled resin, LIS uses water-based slurries with a low amount of organic additives (typically < 5 wt%) as feedstocks. In LIS, a green body is formed by local evaporation of water which causes the suspension to collapse forming a cast, following a mechanism similar to slip casting. Only a small content of organic additives is needed to effectively disperse the ceramic particles and to increase the green strength. The technology is very versatile and can be applied to all ceramic systems that can be dispersed in water. One of the main advantages is that even dark materials such as silicon carbide can be processed without issues related to light scattering and absorption. The presentation will discuss strengths and limitations of LIS compared to other AM technologies and will highlight the latest results for alumina and for silicon carbide ceramics. T2 - 48th International Conference and Expo on Advanced Ceramics and Composites (ICACC2024) CY - Daytona, FL, USA DA - 28.01.2024 KW - Additive Manufacturing KW - Ceramic KW - Water-based KW - Slurry KW - Laser PY - 2024 AN - OPUS4-60054 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Zocca, Andrea A1 - Mühler, T. A1 - Günster, Jens T1 - Continuous layer deposition for the Additive Manufacturing of ceramics by Layerwise Slurry Deposition (LSD-print) N2 - Powder bed technologies are amongst the most successful Additive Manufacturing (AM) techniques. The application of these techniques to most ceramics has been difficult so far, because of the challenges related to the deposition of homogeneous powder layers when using fine powders. In this context, the "layerwise slurry deposition" (LSD) has been developed as a layer deposition method enabling the use of powder bed AM technologies also for advanced ceramic materials. The layerwise slurry deposition consists of the layer-by-layer deposition of a ceramic slurry by means of a doctor blade, in which the slurry is deposited and dried to achieve a highly packed powder. Not only very fine, submicron powders can be processed with low organics, but also the dense powder bed provides excellent support to the parts built. The LSD technology can be combined with binder jetting to develop the so-called “LSD-print” process. LSD-print combines the high-speed printing of binder jetting with the possibility of producing a variety of high-quality ceramics with properties comparable to traditional processing. The latest development of this technology shows that it is possible to print ceramic parts in a continuous process by depositing a layer onto a rotating platform, growing a powder bed following a spiral motion. The unique mechanical stability of the layers in LSD-print allows to grow a powder bed several centimeters thick without any lateral support. The continuous layer deposition allows to achieve a productivity more than 10X higher compared to the linear deposition, approaching a build volume of 1 liter/hour. T2 - 3rd Global Conference and Exhibition on Smart Additive Manufacturing, Design & Evaluation Smart MADE CY - Osaka, Japan DA - 10.04.2024 KW - Additive Manufacturing KW - Ceramic KW - Layerwise slurry deposition KW - LSD-print KW - Slurry KW - Binder jetting PY - 2024 AN - OPUS4-60055 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Fareed, Adnan A1 - Rosalie, Julian M. A1 - Kar, Satyakam A1 - Fähler, Sebastian A1 - Maaß, Robert T1 - Small-scale functional fatigue of a Ni-Mn-Ga Heusler alloy N2 - Functional fatigue of shape-memory alloys is a considerable threat to the reliable service of actuation devices. Here, we demonstrate the essentially degradation-free cyclic phase-transformation behavior of Ni-Mn-Ga microcrystals up to one million stress-driven superelastic cycles. Cyclic dissipation amounts to about 1/5 of the bulk counterpart and remains unaffected during cycling, even after the introduction of dislocation structures via plastic straining. Plastic yielding and the transformation stress largely exceed the known bulk values. However, the transformation-stress is found to depend on plastic pre-straining, which suggests that the size-affected transformation stress is sensitive to the initial defect structure and that it can be tuned by a targeted introduction of dislocations. These findings demonstrate the high suitability of Ni-Mn-Ga as a robust shape-memory alloy in small-scale functional device engineering. KW - Superelasticity KW - Shape-memory alloys KW - Functional fatigue KW - Ni-Mn-Ga PY - 2024 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-600695 DO - https://doi.org/10.1016/j.actamat.2024.119988 VL - 274 SP - 1 EP - 10 PB - Elsevier B.V. AN - OPUS4-60069 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Saber, Yassin A1 - Zocca, Andrea A1 - Günster, Jens T1 - Fully automated and decentralized fused filament fabrication of ceramics for remote applications N2 - Manufacturing of ceramic components in remote (i.e., geographically isolated) settings poses significant challenges where access to conventional manufacturing facilities is limited or non-existent. Fused Filament Fabrication (FFF) enables the rapid manufacturing of ceramic components with complex geometries. Parts formed by FFF require subsequent debinding and sintering to reach full density. Debinding and sintering are typically executed in separate steps with different equipment, necessitating extensive human handling which hinders process automation and may be challenging for the operator in isolated environments. This poster presents an innovative approach: the integration of all process steps into a single, fully automated system, streamlining the process and minimizing human involvement. Our system combines a dual extrusion filament printer with a porous and heat-resistant ceramic print bed. The porous print bed enables mechanical interlocking of the first printed layers, ensuring adhesion and structural integrity during FFF. Ceramic parts are printed onto thin sacrificial rafts, which are built using an interface material with the same binder as the ceramic filament. After the print is completed, the heat-resistant print bed with all parts is transferred seamlessly with a carrier system into a high-temperature furnace for debinding and sintering. During sintering the sacrificial raft is disintegrated, allowing for unconstrained sintering of the ceramic parts and easy removal of the finished parts. In conclusion, our integrated approach enables significant advancements in the fabrication of complex ceramic components in remote environments with increased efficiency and minimal human handling. T2 - yCAM 2024 CY - Tampere, Finnland DA - 06.05.2024 KW - Fused Filament Fabrication PY - 2024 AN - OPUS4-60057 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Tokarski, T. A1 - Nolze, Gert T1 - Exploring Unconventional Uses of Kikuchi Pattern Analysis N2 - The characterization of really unknown phases typically uses 70 to 150 reflectors for lattice metric calculation. The determination of the lattice parameters follows with 4% accuracy. Including a Z correction up to 1% can be reached. The precision of the lattice parameters ratios (a:b:c) is, however, better than 0.1%. T2 - Oxford Users Meeting 2024 CY - Krakow, Poland DA - 14.05.2024 KW - EBSD KW - Kikuchi KW - Lattice parameters KW - Ratio refinement PY - 2024 AN - OPUS4-60086 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Wojciak, K. A1 - Tokarski, T. A1 - Cios, G. A1 - Nolze, Gert T1 - Precision and accuracy during standard-less mapping of local lattice distortions using ebsd and calm technique N2 - Electron Back Scatter Diffraction (EBSD) is a very versatile analytical technique allowing for the characterization of material structure. Historically, diffraction images (Kikuchi patterns) registered during EBSD analysis were solved using Hough/Radon transformation. The last decade brought several novel techniques of experimental pattern analysis, focusing entirely on image analysis routines such as pattern matching, or various variants of High-Resolution EBSD. However, all the above-mentioned techniques require prior knowledge of the material structure to perform orientation analysis. The recently presented algorithm employed in Crystallographic Analysis of Lattice Metric (CALM) software, effectively removes this limitation enabling a standard-less analytical approach in EBSD systems. At its core, the CALM technique couples accurate detection of the Kikuchi bands position, with a rigid construction of reciprocal lattice resulting from translational crystal symmetry. A unique characteristic of the methodology also gives an opportunity for application in the analysis of continuous lattice changes, for example tetragonality mapping. During mapping, however, the geometry of the gnomonic projection (represented by the projection center) is continuously altered decreasing overall algorithm efficiency. The work presents an analysis of the projection center in terms of precision and accuracy. T2 - Oxford User Meeting 2024 CY - Krakow, Poland DA - 14.05.2024 KW - EBSD KW - Kikuchi KW - Lattice parameters KW - Ratio refinement PY - 2024 AN - OPUS4-60087 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Schilling, Markus A1 - Bayerlein, Bernd A1 - Schaarschmidt, J. A1 - von Hartrott, P. A1 - Bruns, M. A1 - Birkholz, H. A1 - Waitelonis, J. A1 - Hickel, Tilmann T1 - Seamless Science with the Platform MaterialDigital (PMD): Demonstration of Semantic Data Integration as Good Practices N2 - Following the new paradigm of materials development, design, and optimization, digitalization is the main goal in materials sciences and engineering (MSE) which imposes a huge challenge. In this respect, the quality assurance of processes and output data as well as the interoperability between applications following FAIR principles are to be ensured. For storage, processing, and querying of data in contextualized form, Semantic Web technologies (SWT) are used since they allow for machine-actionable and human-readable knowledge representations needed for data management, retrieval, and (re)use. The project ‘platform MaterialDigital’ (PMD) aims to bring together and support interested parties from both industrial and academic sectors in a sustainable manner in solving digitalization tasks and implementing digital solutions. Therefore, the establishment of a virtual material data space and the systematization of the handling of hierarchical, process-dependent material data are focused. Core points to be dealt with are the development of agreements on data structures and interfaces implemented in distinct software tools and to offer users specific support in their projects. Furthermore, the platform contributes to a standardized description of data processing methods in materials research. In this respect, selected MSE methods are semantically represented on a prototypical basis which are supposed to serve as best practice examples with respect to knowledge representation and the creation of knowledge graphs used for material data. Accordingly, this poster presentation illustrates demonstrators developed and deployed within the PMD project. Semantically anchored using the mid-level PMD Core Ontology (PMDco), they address data transformation leading to a novel data management which is based on semantic integrated data. The PMD data acquisition pipeline (DAP), which is fueled by traditional, diverse data formats, and a pipeline applying an electronic laboratory notebook (ELN) as data source are displayed. Additionally, the efficient combination of diverse datasets originating from different sources is demonstrated by the representation of a use case dealing with the well-known Orowan relation. T2 - 9. Dresdner Werkstoffsymposium CY - Dresden, Germany DA - 16.05.2024 KW - Semantic Data KW - Data Integration KW - Plattform MaterialDigital KW - Demonstrators KW - Electronic Lab Notebook PY - 2024 AN - OPUS4-60102 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Kindrachuk, Vitaliy A1 - Darvishi Kamachali, Reza T1 - Mean-field modeling and phase-field simulation of grain growth under directional driving forces N2 - Directional grain growth is a common phenomenon in the synthetic and natural evolution of various polycrystals. It occurs in the presence of an external driving force, such as a temperature gradient, along which grains show a preferred, yet competitive, growth. Novel additive manufacturing processes, with intense, localized energy deposition, are prominent examples of when directional grain growth can occur, beneath the melting pool. In this work, we derive a phenomenological mean-field model and perform 3D phase-field simulations to investigate the directional grain growth and its underlying physical mechanisms. The effect of the intensity of driving force is simulated and systematically analyzed at the evolving growth front as well as various cross-sections perpendicular to the direction of the driving force. We found that although the directional growth significantly deviates from normal grain growth, it is still governed by a power law relation α tⁿ with an exponent n ~ 0.6–0.7. The exponent n exhibits a nontrivial dependence on the magnitude of the directional driving force, such that the lowest growth exponent is observed for intermediate driving forces. We elaborate that this can originate from the fact that the forces at grain boundary junctions evolve out of balance under the influence of the directional driving force. With increasing the driving forces, the growth exponent asymptotically approaches a value of n ≈ 0.63, imposed by the largest possible grain aspect ratio for given grain boundary energies. The current combined mean-field and phase-field framework pave the way for future exploration in broader contexts such as the evolution of complex additively manufactured microstructures. KW - Additive manufacturing KW - Phase-field simulation KW - Grain growth KW - Mean-field modelling KW - Directional grain growth PY - 2024 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-593210 DO - https://doi.org/10.1016/j.mtla.2023.101989 SN - 2589-1529 VL - 33 SP - 1 EP - 10 PB - Elsevier AN - OPUS4-59321 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - THES A1 - Ávila Calderón, Luis Alexander T1 - Mechanisches Verhalten von additiv gefertigtem nichtrostendem Stahl X2CrNiMo17-12-2 (AISI 316L) und Vergleich zur konventionell gefertigten Variante T1 - Mechanical behavior of additively manufactured stainless steel X2CrNiMo17-12-2 (AISI 316L) and comparison with a conventionally manufactured variant N2 - Die additive Fertigung (AM) metallischer Werkstoffe ist eine Technologie, die zunehmend Gegenstand von Forschungsaktivitäten und industrieller Anwendung ist. Dennoch steht sie noch vor Herausforderungen, um eine breite Nutzung in sicherheitsrelevanten Anwendungen zu erreichen. Die Hauptgründe für die Verzögerung des technologischen Durchbruchs zugunsten von AM-Metallen gegenüber konventionell hergestellten Varianten sind das Fehlen eines tieferen Verständnisses der Prozess-Struktur-Eigenschafts-Beziehungen und die begrenzte Verfügbarkeit von Daten zu den Materialeigenschaften. In diesem Kontext stellt diese Arbeit einen Beitrag sowohl zum Verständnis der Prozess-Struktur-Eigenschafts-Beziehungen als auch zur Verbesserung der Datenlage von 316L dar, einem häufig als Konstruktionswerkstoff in verschiedenen Hochtemperaturbauteilen verwendeten Werkstoff. Die Arbeit legt den Fokus auf die mittels Laser-Pulverbettschmelzen hergestellte Werkstoffvariante, PBF-LB/M/316L. Eine konventionell hergestellte Variante, HR/316L, wurde auch untersucht. Bei PBF-LB/M/316L wurde zusätzlich der Effekt ausgewählter Wärmebehandlungen ausgewertet. Die Untersuchung umfasste die Charakterisierung der mechanischen Eigenschaften und der Verformungs- und Schädigungsmechanismen bei erhöhten Prüftemperaturen bei LCF und Kriechen, wo die Daten und Wissenslage am spärlichsten ist. Außerdem hat die untersuchte PBF-LB/M/316L-Wersktoffvariante einen geringen Porositätsgrad. Somit hat diese Arbeit die Mikrostruktur stärker in den Fokus genommen als die meisten bisher in der Literatur verfügbaren Studien. Die mechanische Prüfkampagne umfasste Zugversuche zwischen Raumtemperatur und 650 °C, LCF-Versuche zwischen Raumtemperatur und 600 °C sowie Kriechversuche bei 600 °C und 650 °C. In Ermangelung konkreter Richtlinien und Normen wurde die Charakterisierung zumeist anhand der bestehenden internationalen Prüfnormen und Probengeometrien durchgeführt. Aus jedem dieser Prüfverfahren wurden die entsprechenden Festigkeits- und Verformungskennwerte ermittelt. Darüber hinaus wurde mit Hilfe gezielter mikrostruktureller Untersuchungen ein Beitrag zum Verständnis des Zusammenhangs zwischen der Mikrostruktur und den mechanischen Eigenschaften in Bezug auf die Verformungs- und Schädigungsmechanismen geleistet. Die Dehngrenze von PBF-LB/M/316L ist etwa doppelt so hoch wie die von HR/316L und dieser Trend setzt sich mit ansteigender Prüftemperatur fort. Die Bruchdehnung ist bei allen Prüftemperaturen geringer. PBF-LB/M/316L weist über den größten Teil der Ermüdungslebensdauer vor allem bei Raumtemperatur höhere zyklische Spannungen als HR/316L auf. Ausschließlich bei den kleinsten Dehnungs-schwingbreiten sind die Ermüdungslebensdauer ausgeprägt kürzer. Das Wechselverformungsverhalten von PBF-LB/M/316L ist durch eine Anfangsverfestigung gefolgt von einer kontinuierlichen Entfestigung charakterisiert, welche bis zum Auftreten der zum Versagen führenden Entfestigung stattfindet. Die Kriechbruchzeiten und die Dauer jeder Kriechphase sind bei allen Kombinationen von Prüfparametern bei PBF-LB/M/316 kürzer als bei HR/316L. Die Spannungsabhängigkeit von PBF-LB/M/316L ist im Vergleich zu HR/316L geringer und die Duktilität beim Kriechen kleiner. Die minimale Kriechrate wird bei allen geprüften Parameterkombinationen bei deutlich geringeren Kriechdehnungen erreicht. Eine Wärmebehandlung bei 450 °C / 4 h bewirkt keine wesentliche Änderungen der Mikrostruktur und Zugversuchseigenschaften. Eine zusätzliche Wärmebehandlung bei 900 °C / 1 h verursacht eine Abnahme der Dehngrenze des PBF-LB/M/316L. Diese blieb aber immer noch um den Faktor 1,5x höher als bei HR/316L. Die Verformungsmerkmale wurden kaum davon beeinflusst. Bezüglich des Kriechverhaltens hat die Wärmebehandlung bei 900 °C / 1 h längere sekundäre und tertiäre Kriechstadien bewirkt und die Kriechdehnung hat sich signifikant erhöht. Die Bruchbilder unterscheiden sich generell nicht nur aber vor allem mit ansteigender Prüftemperatur, bei der bei PBF-LB/M/316L oft interkristalline Rissbildung beobachtet wurde. Die Zellstruktur trägt als der Hauptfaktor zu den unterschiedlichen mechanischen Eigenschaften im Vergleich zur HR/316L-Variante bei. Darüber hinaus spielen mutmaßlich die Kornmorphologie, die Stapelfehlerenergie und der Stickstoffgehalt eine Rolle. N2 - Metal additive manufacturing (AM) is a technology that is increasingly the subject of research activities and industrial applications. However, it still faces challenges to achieve widespread use in safety-relevant applications. The main reasons for the delay of this technological breakthrough in favor of AM metals over conventionally manufactured variants are the lack of a deeper understanding of process-structure-property relationships and the limited availability of data on material properties. In this context, this work contributes to both achieving a better understanding of process-structure-property relationships and the improvement of data for 316L, an alloy frequently used as a structural material in various high-temperature components. The work focuses on a material variant produced by laser pow-der bed fusion, PBF-LB/M/316L. A conventionally produced variant, HR/316L, was also investigated. For PBF-LB/M/316L, the effect of selected heat treatments was also evaluated. The investigation included the characterization of the mechanical properties and the related deformation and damage mechanisms at elevated test temperatures in LCF and creep, where data and knowledge are scarce. The PBF-LB/M/316L variant studied has a low degree of porosity. Thus, this work is more focused on the microstructure than most studies available in the literature. The mechanical test campaign included tensile tests between room temperature and 650 °C, LCF tests between room temperature and 600 °C, and creep tests at 600 °C and 650 °C. In the absence of concrete guidelines and standards for testing of AM metals, the characterization mostly took place using existing international test standards and specimen geometries. From each of the test methods, corresponding strength, and deformation characteristic values were determined. In addition, targeted microstructural investigations contributed to understanding the relationship between the microstructure and the mechanical properties in terms of deformation and damage mechanisms. The proof stress of PBF-LB/M/316L is about twice that of HR/316L. This trend remains with increasing test temperature. The elongation after fracture is lower at all test temperatures. Regarding LCF, PBF-LB/M/316L exhibits higher cyclic stresses than HR/316L for most of the fatigue life, especially at room temperature. Exclusively at the smallest strain amplitudes, the fatigue lives of PBF-LB/M/316L are markedly shorter than in HR/316L. The cyclic stress-strain deformation behavior of PBF-LB/M/316L features an initial strain hardening followed by a continuous softening, which occurs until the softening leading to failure takes place. The creep rupture times and the duration of each creep stage are shorter for PBF-LB/M/316 than for HR/316L for all combinations of test parameters. The stress dependence of PBF-LB/M/316L is lower, and the creep ductility is smaller compared to HR/316L. The minimum creep rate is reached at significantly lower creep extensions for all parameter combinations tested. A heat treatment at 450 °C / 4 h did not cause significant changes in the microstructure and tensile behavior. An additional heat treatment at 900 °C / 1 h caused a decrease in the proof stress of PBF-LB/M/316L. However, it still remained higher than the one of HR/316L by a factor of 1.5x. The deformation characteristics were hardly affected. Regarding the creep behavior, this latter heat treatment at 900 °C / 1 h caused longer secondary and tertiary creep stages, and the creep strain increased significantly. The fracture characteristics generally differed, which happened not only but especially with increasing test temperature, where intergranular cracking often took place in PBF-LB/M/316L. The cellular structure is considered the main factor contributing to the different mechanical properties compared to the HR/316L variant. In addition, grain morphology, stacking fault energy, and nitrogen content might play a role. KW - AGIL KW - Additive Fertigung KW - Laser-Pulverbettschmelzen KW - Mikrostrukturentwicklung KW - 316L KW - LCF KW - Kriechen KW - Additive Manufacturing KW - Microstructure KW - Mechanical Properties KW - Mechanische Eigenschaften PY - 2024 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-597143 DO - https://doi.org/10.14279/depositonce-19828 SP - 1 EP - 190 CY - Berlin AN - OPUS4-59714 LA - deu AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Wang, Zengquan A1 - Riechers, Birte A1 - Derlet, Peter M. A1 - Maaß, Robert T1 - Atomic cluster dynamics causes intermittent aging of metallic glasses N2 - In the past two decades, numerous relaxation or physical aging experiments of metallic glasses have revealed signatures of intermittent atomic-scale processes. Revealed via intensity cross-correlations from coherent scattering using X-ray photon correlation spectroscopy (XPCS), the observed abrupt changes in the time-domain of atomic motion does not fit the picture of gradual slowing down of relaxation times and their origin continues to remain unclear. Using a binary Lennard-Jones model glass subjected to microsecond-long isotherms, we show here that temporally and spatially heterogeneous atomic-cluster activity at different length-scales drive the emergence of highly non-monotonous intensity cross-correlations. The simulated XPCS experiments reveal a variety of time-dependent intensity-cross correlations that, depending on both the structural evolution and the 𝑞-space sampling, give detailed insights into the possible structural origins of intermittent aging measured with XPCS. KW - Metallic glasses KW - Aging KW - Molecular dynamics KW - XPCS PY - 2024 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-595415 DO - https://doi.org/10.1016/j.actamat.2024.119730 SN - 1359-6454 VL - 267 SP - 1 EP - 9 PB - Elsevier B.V. CY - Amsterdam, Niederlande AN - OPUS4-59541 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Kuchenbecker, Petra T1 - Herausforderungen bei der Granulometrie von (technischen) Nano-Pulvern N2 - Einführungsvortrag im Rahmen der Veranstaltung der BAM-Akademie zur Anwendung der OECD TG 124 "Volume Specific Surface Area of Manufactured Nanomaterials" zu Herausforderungen bei der Granulometrie von Nanopulvern. Es werden die Einflüsse von Partikelform, Breite der Partikelgrößenverteilung und Agglomeration/ Aggregation auf das Messergebnis sowie die Vergleichbarkeit der Ergebnisse verschiedener Messverfahren dargelegt. T2 - BAM Akademie II: Info-Tage "Nano or not Nano" CY - Online meeting DA - 25.01.2024 KW - Nanopulver KW - Granulometrie KW - Partikelgröße KW - VSSA KW - OECD TG 124 PY - 2024 AN - OPUS4-59558 LA - deu AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - THES A1 - Charmi, Amir T1 - A multiscale numerical framework for the simulation of anistropic material response of additively manufactured stainless steel 316L undergoing large plastic deformation N2 - Additive manufacturing (AM) offers significantly greater freedom of design compared to conventional manufacturing processes since the final parts are built layer by layer. This enables metal AM, also known as metal 3D printing, to be utilized for improving efficiency and functionality, for the production of parts with very complex geometries, and rapid prototyping. However, despite many technological advancements made in recent years, several challenges hinder the mass adoption of metal AM. One of these challenges is mechanical anisotropy which describes the dependency of material properties on the material orientation. Therefore, in this work, stainless steel 316L parts produced by laser-based powder bed fusion are used to isolate and understand the root cause of anisotropy in AM parts. Furthermore, an efficient and accurate multiscale numerical framework is presented for predicting the deformation behavior of actual AM parts on the macroscale undergoing large plastic deformations. Finally, a novel constitutive model for the plastic spin is formulated to capture the influence of the microstructure evolution on the material behavior on the macroscale. KW - Additive Fertigung KW - Austenitischer Stahl KW - Finite-Elemente-Methode KW - Mehrskalenmodell KW - Simulation PY - 2024 UR - https://nbn-resolving.org/urn:nbn:de:gbv:wim2-20240207-173356-002 DO - https://doi.org/10.25643/dbt.59550 SP - 1 EP - 163 PB - Bauhaus-Universität Weimar CY - Weimar AN - OPUS4-59511 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Kuchenbecker, Petra T1 - Einführung: Volume Specific Surface Area (VSSA) N2 - Im Rahmen der 2. BAM-Akademie-Veranstaltung "Nano or not Nano" wurde die OECD TG 124 "Volume Specific Surface Area of Manufactured Nanomaterials" vorgestellt. Der Vortrag enthält ein Einführung zur VSSA mit Definitionen, Vorteilen und Einschränkungen. T2 - BAM Akademie II: Info-Tage "Nano or not Nano" CY - Online meeting DA - 25.01.2024 KW - Nano powder KW - VSSA KW - Specific surface KW - OECD TG PY - 2024 AN - OPUS4-59560 LA - deu AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Kuchenbecker, Petra T1 - Bestimmung der Skelettdichte mittels Gaspyknometrie N2 - Im Rahmen des 2. BAM-Akademie Info-Tages "Nano or not Nano" wurde die OECD TG 124 "Volume Specific Surface Area of Manufactured Nanomaterials" vorgestellt. Der Vortrag beschreibt detailliert das Messverfahren der He-Gaspyknometrie zur Bestimmung der Skelettdichte von Pulvern und geht auf Anwendbarkeit, Besonderheiten bei Nanopulvern und wichtige Einstellparameter für die Messung ein. T2 - BAM Akademie II: Info-Tage "Nano or not Nano" CY - Online meeting DA - 25.01.2024 KW - Pycnometry KW - Density KW - Nano powder PY - 2024 AN - OPUS4-59561 LA - deu AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Mrkwitschka, Paul A1 - Rühle, Bastian A1 - Kuchenbecker, Petra A1 - Löhmann, Oliver A1 - Lindemann, Franziska A1 - Hodoroaba, Vasile-Dan T1 - Embedding and cross-sectioning as a sample preparation procedure for accurate and representative size and shape measurement of nanopowders N2 - Reliable measurement of the size of polydisperse, complex-shaped commercial nanopowders is a difficult but necessary task, e.g., for regulatory requirements and toxicity risk assessment. Suitable methods exist for the accurate characterization of the size of non-aggregated, stabilized, spherical and monodisperse nanoparticles. In contrast, industrial nanoscale powders usually require dedicated sample preparation procedures developed for the analysis method of choice. These nano-powders tend to agglomerate and/or aggregate, a behavior which in combination with an innate broad particle size distribution and irregular shape often significantly alters the achievable accuracy of the measured size parameters. The present study systematically tests two commercially available nanoscale powders using different sample preparation methods for correlative analysis by scanning electron microscopy, dynamic light scattering, Brunauer–Emmet–Teller method and differential mobility analysis. One focus was set on the sample preparation by embedding nanoparticles in carbon-based hot-mounting resin. Literature on this topic is scarce and the accuracy of the data extracted from cross sections of these particles is unclearly stated. In this paper systematic simulations on the deviation of the size parameters of well-defined series of nanoparticles with different shapes from the nominal value were carried out and the contributing factors are discussed. KW - Nanopowder KW - Electron microscopy KW - Sample preparation KW - Cross-sectioning KW - Cerium oxide KW - Zinc oxide PY - 2024 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-593289 DO - https://doi.org/10.1038/s41598-023-51094-0 SN - 2045-2322 VL - 14 SP - 1 EP - 10 PB - Springer Nature CY - London AN - OPUS4-59328 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Zia, Ghezal Ahmad Jan A1 - Hanke, Thomas A1 - Skrotzki, Birgit A1 - Völker, Christoph A1 - Bayerlein, Bernd T1 - Enhancing Reproducibility in Precipitate Analysis: A FAIR Approach with Automated Dark-Field Transmission Electron Microscope Image Processing N2 - AbstractHigh-strength aluminum alloys used in aerospace and automotive applications obtain their strength through precipitation hardening. Achieving the desired mechanical properties requires precise control over the nanometer-sized precipitates. However, the microstructure of these alloys changes over time due to aging, leading to a deterioration in strength. Typically, the size, number, and distribution of precipitates for a quantitative assessment of microstructural changes are determined by manual analysis, which is subjective and time-consuming. In our work, we introduce a progressive and automatable approach that enables a more efficient, objective, and reproducible analysis of precipitates. The method involves several sequential steps using an image repository containing dark-field transmission electron microscopy (DF-TEM) images depicting various aging states of an aluminum alloy. During the process, precipitation contours are generated and quantitatively evaluated, and the results are comprehensibly transferred into semantic data structures. The use and deployment of Jupyter Notebooks, along with the beneficial implementation of Semantic Web technologies, significantly enhances the reproducibility and comparability of the findings. This work serves as an exemplar of FAIR image and research data management. KW - Industrial and Manufacturing Engineering KW - General Materials Science KW - Automated image analysis KW - FAIR research data management KW - Reproducibility KW - microstructural changes PY - 2024 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-593905 DO - https://doi.org/10.1007/s40192-023-00331-5 SN - 2193-9772 SP - 1 EP - 15 PB - Springer Science and Business Media LLC CY - Heidelberg AN - OPUS4-59390 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Bayerlein, Bernd A1 - Schilling, Markus A1 - Birkholz, Henk A1 - Jung, Matthias A1 - Waitelonis, Jörg A1 - Mädler, Lutz A1 - Sack, Harald T1 - PMD Core Ontology: Achieving semantic interoperability in materials science N2 - Knowledge representation in the Materials Science and Engineering (MSE) domain is a vast and multi-faceted challenge: Overlap, ambiguity, and inconsistency in terminology are common. Invariant (consistent) and variant (context-specific) knowledge are difficult to align cross-domain. Generic top-level semantic terminology often is too abstract, while MSE domain terminology often is too specific. In this paper, an approach how to maintain a comprehensive MSE-centric terminology composing a mid-level ontology–the Platform MaterialDigital Core Ontology (PMDco)–via MSE community-based curation procedures is presented. The illustrated findings show how the PMDco bridges semantic gaps between high-level, MSE-specific, and other science domain semantics. Additionally, it demonstrates how the PMDco lowers development and integration thresholds. Moreover, the research highlights how to fuel it with real-world data sources ranging from manually conducted experiments and simulations with continuously automated industrial applications. KW - Ontology KW - Materials science and engineering KW - Knowledge representation KW - Reproducibility KW - Semantic interoperability KW - Semantic data integration PY - 2024 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-592948 DO - https://doi.org/10.1016/j.matdes.2023.112603 SN - 0264-1275 VL - 237 SP - 1 EP - 12 PB - Elsevier CY - Amsterdam AN - OPUS4-59294 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Blaeß, Carsten A1 - Müller, Ralf A1 - Boccaccini, A. R. T1 - Sintering and crystallization kinetics of bioactive glass 13-93 N2 - This study investigates the sintering and crystallization behavior and kinetic of the bioactive glass (BG) 13–93 with nominal composition (in mol%): 54.6 SiO2 - 1.7 P2O3 - 22.1 CaO - 6.0 Na2O - 7.9 K2O - 7.7 MgO. Sintering and crystallization were investigated non-isothermally for various particle size fractions smaller than 315 μm as well as for bulk samples. Densification was not hindered by the presence of crystalline phases across all particle size fractions. Afterwards, wollastonite was found as the dominant crystal phase at higher temperature which resorb primary surface precipitation-like quartz crystallites. The growth direction shifts into volume when the sample surface is nearly covered. The crystal growth rate of wollastonite was calculated from the crystalline surface layer thickness measured during heating. The findings of this study are relevant for the high temperature processing of BG 13–93. KW - Bioactive glass KW - Sintering KW - Crystallization PY - 2024 DO - https://doi.org/10.1016/j.jnoncrysol.2023.122790 SN - 0022-3093 VL - 627 SP - 1 EP - 7 PB - Elsevier AN - OPUS4-59337 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Andreoli, A. F. A1 - Fantin, Andrea A1 - Kasatikov, S. A1 - Bacurau, V. P. A1 - Widom, M. A1 - Gargarella, P. A1 - Mazzer, E. M. A1 - Woodcock, T. G. A1 - Nielsch, K. A1 - Coury, F. G. T1 - The impact of chemical short-range order on the thermophysical properties of medium- and high-entropy alloys N2 - The unusual behavior observed in the coefficient of thermal expansion and specific heat capacity of CrFeNi, CoCrNi, and CoCrFeNi medium/high-entropy alloys is commonly referred to as the K-state effect. It is shown to be independent of the Curie temperature, as demonstrated by temperature-dependent magnetic moment measurements. CoCrFeNi alloy is chosen for detailed characterization; potential reasons for the K-state effect such as texture, recrystallization, and second-phase precipitation are ruled out. An examination of the electronic structure indicates the formation of a pseudo-gap in the Density of States, which suggests a specific chemical interaction between Ni and Cr atoms upon alloying. Hybrid Monte Carlo/Molecular Dynamic (MC/MD) simulations indicate the presence of non-negligible chemical short-range order (CSRO). Local lattice distortions are shown to be negligible, although deviations around Cr and Ni elements from those expected in a fully disordered structure are experimentally observed by X-ray absorption spectroscopy. The determined bonding distances are in good agreement with MC/MD calculations. A mechanism is proposed to explain the anomalies and calorimetric experiments and their results are used to validate the mechanism. KW - Mechanical Engineering KW - Mechanics of Materials KW - General Materials Science PY - 2024 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-595869 DO - https://doi.org/10.1016/j.matdes.2024.112724 SN - 0264-1275 VL - 238 SP - 1 EP - 15 PB - Elsevier B.V. AN - OPUS4-59586 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Was, G.S. A1 - Bahn, C.-B. A1 - Busby, J. A1 - Cui, B. A1 - Farkas, D. A1 - Gussev, M. A1 - Rigen He, M. A1 - Hesterberg, J. A1 - Jiao, Z. A1 - Johnson, D. A1 - Kuang, W. A1 - McMurtrey, M. A1 - Robertson, I. A1 - Sinjlawi, A. A1 - Song, M. A1 - Stephenson, K. A1 - Sun, K. A1 - Swaminathan, Srinivasan A1 - Wang, M. A1 - West, E. T1 - How irradiation promotes intergranular stress corrosion crack initiation N2 - Irradiation assisted stress corrosion cracking (IASCC) is a form of intergranular stress corrosion cracking that occurs in irradiated austenitic alloys. It requires an irradiated microstructure along with high temperature water and stress. The process is ubiquitous in that it occurs in a wide range of austenitic alloys and water chemistries, but only when the alloy is irradiated. Despite evidence of this degradation mode that dates back to the 1960s, the mechanism by which it occurs has remained elusive. Here, using high resolution electron backscattering detection to analyze local stress-strain states, high resolution transmission electron microscopy to identify grain boundary phases at crack tips, and decoupling the roles of stress and grain boundary oxidation, we are able to unfold the complexities of the phenomenon to reveal the mechanism by which IASCC occurs. The significance of the findings impacts the mechanical integrity of core components of both current and advanced nuclear reactor designs worldwide. KW - Irradiation KW - Stress corrosion cracking KW - Grain boundaries KW - Oxidation KW - Austenitic alloys PY - 2024 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-595748 DO - https://doi.org/10.1016/j.pmatsci.2024.101255 SN - 0079-6425 VL - 143 SP - 1 EP - 15 PB - Elsevier AN - OPUS4-59574 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Mohring, W. A1 - Karafiludis, Stephanos A1 - Manzoni, Anna M. A1 - Laplanche, G. A1 - Schneider, M. A1 - Stephan-Scherb, C. T1 - High-Temperature Corrosion of High- and Medium-Entropy Alloys CrMnFeCoNi and CrCoNi Exposed to a Multi-Oxidant Atmosphere H2O–O2–SO2 N2 - AbstractThe high-temperature corrosion behaviors of the equimolar CrCoNi medium-entropy alloy and CrMnFeCoNi high-entropy alloy were studied in a gas atmosphere consisting of a volumetric mixture of 10% H2O, 2% O2, 0.5% SO2, and 87.5% Ar at 800 °C for up to 96 h. Both alloys were initially single-phase fcc with a mean grain size of ~ 50 μm and a homogeneous chemical composition. The oxide layer thickness of CrMnFeCoNi increased linearly with exposure time while it remained constant at ~ 1 μm for CrCoNi. A Cr2O3 layer and minor amounts of (Co,Ni)Cr2O4 developed on the latter while three oxide layers were detected on the former, i.e., a thin and continuous chromium rich oxide layer at the oxide/alloy interface, a dense (Mn,Cr)3O4 layer in the center and a thick and porous layer of Mn3O4 and MnSO4 at the gas/oxide interface. Additionally, a few metal sulfides were observed in the CrMnFeCoNi matrix. These results were found to be in reasonable agreement with thermodynamic calculations. KW - high entropy alloys KW - corrosion KW - oxidation KW - scanning electron microscopy KW - sulfidation KW - CrMnFeCoNi PY - 2024 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-594189 DO - https://doi.org/10.1007/s44210-023-00026-8 SP - 1 EP - 17 PB - Springer Science and Business Media LLC AN - OPUS4-59418 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Günster, Jens A1 - Sänger, Johanna T1 - Tailoring powder properties for the light based volumetric additive manufacture of Ceramics N2 - In order to be able to manipulate ceramic powder compacts and ceramic suspensions (slurries) within their volume with light, a minimum transparency of the materials is required. Compared to polymers and metals, ceramic materials are characterized by the fact that they have a wide electronic band gap and therefore a wide optical window of transparency. The optical window generally ranges from less than 0.3 µm to 5 µm wavelength. In order to focus light into the volume of a ceramic powder compact, its light scattering properties must therefore be tailored. In this study, we present the physical background and material development strategies for the application of two-photon polymerization (2PP) and selective volumetric sintering for the additive manufacturing of structures in the volume of ceramic slips and green compacts. T2 - SmartMade 2024 CY - Osaka, Japan DA - 10.04.2024 KW - Additive Manufacturing KW - Two Photon Polymerization KW - Advanced ceramics PY - 2024 AN - OPUS4-59888 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Günster, Jens A1 - Sänger, Johanna A1 - Pauw, Brian T1 - Tailoring powder properties for the light based volumetric additive manufacture of Ceramics N2 - Manipulating ceramic powder compacts and ceramic suspensions (slurries) within their volume with light requires a minimum transparency of the materials. Compared to polymers and metals, ceramic materials are unique as they offer a wide electronic band gap and thus a wide optical window of transparency. The optical window typically ranges from below 0.3 µm up to 5µm wavelength. Hence, to penetrate with light into the volume of a ceramic powder compound, its light scattering properties need to be investigated and tailored. In the present study we introduce the physical background and material development strategies to apply two-photon-polymerization (2PP), and other volumetric methods for the additive manufacture of filigree structures within the volume of ceramic slurries. T2 - ICACC 2024 CY - Daytona Beach, Florida, USA DA - 28.01.2024 KW - Additive Manufacturing KW - Two Photon Polymerization KW - Advanced ceramics PY - 2024 AN - OPUS4-59889 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Schilling, Markus T1 - Interoperabilität und Wiederverwendung von Materialdaten: Der Weg zu Daten- und Wissensrepräsentationen in der PMD N2 - Die Integration und Wiederverwendung von Wissen und Daten aus der Herstellung, Bearbeitung und Charakterisierung von Materialien wird im Zuge der digitalen Transformation in der Materialwissenschaft und Werkstofftechnologie in verschiedenen Projekten behandelt. Dabei liegt der Fokus auf der Interoperabilität von Daten und Anwendungen, die nach den FAIR-Prinzipien erstellt und veröffentlicht werden. Zur Umsetzung eines komplexen Datenmanagements und der Digitalisierung im Bereich der Materialwissenschaften gewinnen Ontologien zunehmend an Bedeutung. Sie ermöglichen sowohl menschenlesbare als auch maschinenverständliche und -interpretierbare Wissensrepräsentationen durch semantische Konzeptualisierungen. Im Rahmen des Projektes Plattform MaterialDigital (PMD, materialdigital.de), welches in dieser Präsentation vorgestellt wird, werden Ontologien verschiedener Ebenen entwickelt (verbindende mid-level sowie Domänen-Ontologien). Die PMD-Kernontologie (PMD Core Ontology - PMDco) ist eine Ontologie der mittleren Ebene, die Verbindungen zwischen spezifischeren MSE-Anwendungsontologien und domänenneutralen Konzepten herstellt, die in bereits etablierten Ontologien höherer Ebenen (top-level Ontology) verwendet werden. Sie stellt somit einen umfassenden Satz von durch Konsensbildung in der Gemeinschaft (geteiltes Vokabular) entstanden Bausteinen grundlegender Konzepte aus der Materialwissenschaft und Werkstofftechnik (MSE) dar. In dieser Präsentation wird die PMDco adressiert. Weiterhin wird eine auf die PMDco bezogene normenkonforme ontologische Repräsentation zur Speicherung und Weiterverarbeitung von Zugversuchsdaten – die Tensile Test Ontology (TTO) – präsentiert, die in enger Zusammenarbeit mit dem zugehörigen DIN-Standardisierungsgremium NA 062-01-42 AA erstellt wurde. Dies umfasst den Weg von der Entwicklung einer Ontologie nach Norm, der Konvertierung von Daten aus Standardtests in das interoperable RDF-Format bis hin zur Verbindung von Ontologie und Daten. Auf Grundlage der dabei entwickelten Struktur und Vorgehensweise können weitere Materialcharakterisierungsmethoden semantisch beschrieben werden, woraus sich in diesem Zusammenhang Kooperationsmöglichkeiten ergeben. T2 - 20. Sitzung des NA 062-01-43 AA CY - Online meeting DA - 28.05.2024 KW - Semantische Daten KW - Plattform Material Digital KW - Ontologie KW - Normung KW - Wissensrepräsentation PY - 2024 AN - OPUS4-60178 LA - deu AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Schilling, Markus A1 - Niebergall, Ute A1 - Marschall, Niklas A1 - Meinel, Dietmar A1 - Böhning, Martin T1 - Relation of craze to crack length during slow crack growth phenomena in high‐density polyethylene N2 - The craze‐crack mechanism occurring in high‐density polyethylene (HDPE) causing slow crack growth and environmental stress cracking is investigated in detail with respect to the relation of crack length and the related craze zone. This is essential for the understanding of the resulting features of the formed fracture surface and their interpretation in the context of the transition from crack propagation to ductile shear deformation. It turns out that an already formed craze zone does not inevitably result in formation of a propagating crack, but could also undergo ductile failure. For the examination, the full notch creep test (FNCT) was employed with a subsequent advanced fracture surface analysis that was performed using various imaging techniques: light microscopy, laser scanning microscopy, scanning electron microscopy, and X‐ray micro computed tomography scan. FNCT specimens were progressively damaged for increasing durations under standard test conditions applying Arkopal, the standard surfactant solution, and biodiesel as test media were used to analyze the stepwise growth of cracks and crazes. From considerations based on well‐established fracture mechanics approaches, a theoretical correlation between the length of the actual crack and the length of the preceding craze zone was established that could be evidenced and affirmed by FNCT fracture surface analysis. Moreover, the yield strength of a HDPE material exposed to a certain medium as detected by a classic tensile test was found to be the crucial value of true stress to induce the transition from crack propagation due to the craze‐crack mechanism to shear deformation during FNCT measurements. Highlights - Progress of crack formation in high‐density polyethylene is analyzed by different imaging techniques - Determined growth rates depend on distinction between craze zone and crack - The ratio of the present crack to the anteceding craze zone is validated theoretically - The transition from crack propagation to ductile shear deformation is identified - An already formed craze zone may still fail by ductile mechanisms KW - Craze-crack mechanism KW - Environmental stress cracking (ESC) KW - Full notch creep test (FNCT) KW - Laser scanning microscopy (LSM) KW - Slow crack growth (SCG) KW - X-ray computed tomography (CT) PY - 2024 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-601831 DO - https://doi.org/10.1002/pen.26698 SN - 1548-2634 VL - 64 IS - 6 SP - 2387 EP - 2403 PB - Wiley AN - OPUS4-60183 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Bordeenithikasem, Punnathat A1 - Carpenter, Kalind C. A1 - Hofmann, Douglas C. A1 - White, Victor E. A1 - Yee, Karl Y. A1 - Rizzardi, Quentin A1 - Maher, Jacob A1 - Maaß, Robert T1 - Miniaturized bulk metallic glass gripping structures for robotic mobility platforms N2 - Advancements in bulk metallic glass thermoplastic forming unleash the potential to fabricate microscale metallic features with unparalleled precision and durability, i.e. microspine gripping structures for mobility platforms on planetary or in-space robots. Four designs of grippers were fabricated and rigorously tested. Coefficient of friction on four test surfaces were measured and compared to SiC paper and Velcro. The hardness and elasticity of the bulk metallic glasses make them a game-changer in the field, offering a superior alternative to conventional nonmetallic grippers. KW - Bulk metallic glasses KW - Thermoplastic forming KW - Mobility KW - Microspine PY - 2024 DO - https://doi.org/10.1016/j.actaastro.2024.03.040 SN - 0094-5765 VL - 219 SP - 399 EP - 407 PB - Elsevier Ltd. CY - Amsterdam, Niederlande AN - OPUS4-60182 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Dzugan, J. A1 - Lucon, E. A1 - Koukolikova, M. A1 - Li, Y. A1 - Rzepa, S. A1 - Yasin, M.S. A1 - Shao, S. A1 - Shamsaei, N. A1 - Seifi, M. A1 - Lodeiro, M. A1 - Lefebvre, F. A1 - Mayer, U. A1 - Olbricht, J. A1 - Houska, M. A1 - Mentl, V. A1 - You, Z. T1 - ASTM interlaboratory study on tensile testing of AM deposited and wrought steel using miniature specimens N2 - An interlaboratory study, involving eigth international laboratories and coordinated by COMTES FHT (Czech Republic), was conducted to validate tensile measurements obtained using miniature specimens on additively manufactured (AM) components and artifacts. In addition to AM 316L stainless steel (316L SS), a wrought highstrength steel (34CrNiMo6V, equivalent to AISI 4340) was also used. Based on the results, a precision statement in accordance with ASTM E691 standard practice was developed, intended for inclusion in a proposed annex to the ASTM E8/E8M tension testing method. The primary outcomes of the study highlighted the agreement between yield and tensile strength measured from miniature and standard-sized tensile specimens. Furthermore, most tensile properties exhibited similar standard deviations, offering users insight into the efficacy of miniature specimen applications. KW - 316L stainless steel KW - Additive manufacturing KW - High-strength steel KW - Miniature specimens KW - Tensile tests PY - 2024 DO - https://doi.org/10.1016/j.tafmec.2024.104410 SN - 0167-8442 VL - 131 SP - 1 EP - 13 PB - Elsevier B.V. AN - OPUS4-60180 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Kianinejad, Kaveh A1 - Darvishi Kamachali, Reza A1 - Khedkar, Abhinav A1 - Manzoni, Anna A1 - Agudo Jácome, Leonardo A1 - Schriever, Sina A1 - Saliwan Neumann, romeo A1 - Megahed, Sandra A1 - Heinze, Christoph A1 - Kamrani, Sepideh A1 - Fedelich, Bernard T1 - Creep anisotropy of additively manufactured Inconel-738LC: Combined experiments and microstructure-based modeling N2 - The current lack of quantitative knowledge on processing-microstructure–property relationships is one of the major bottlenecks in today’s rapidly expanding field of additive manufacturing. This is centrally rooted in the nature of the processing, leading to complex microstructural features. Experimentally-guided modeling can offer reliable solutions for the safe application of additively manufactured materials. In this work, we combine a set of systematic experiments and modeling to address creep anisotropy and its correlation with microstructural characteristics in laser-based powder bed fusion (PBF-LB/M) additively manufactured Inconel-738LC (IN738LC). Three sample orientations (with the tensile axis parallel, perpendicular, and 45° tilted, relative to the building direction) are crept at 850 °C, accompanied by electron backscatter secondary diffraction (EBSD), scanning electron microscopy (SEM) and transmission electron microscopy (TEM) investigations. A crystal plasticity (CP) model for Ni-base superalloys, capable of modeling different types of slip systems, is developed and combined with various polycrystalline representative volume elements (RVEs) built on the experimental measurements. Besides our experiments, we verify our modeling framework on electron beam powder bed fusion (PBF-EB/M) additively manufactured Inconel-738LC. The results of our simulations show that while the crystallographic texture alone cannot explain the observed creep anisotropy, the superlattice extrinsic stacking faults (SESF) and related microtwinning slip systems play major roles as active deformation mechanisms. We confirm this using TEM investigations, revealing evidence of SESFs in crept specimens. We also show that the elongated grain morphology can result in higher creep rates, especially in the specimens with a tilted tensile axis. KW - Additive manufactured Ni-base superalloys KW - Creep KW - Crystal plasticity KW - Superlattice extrinsic stacking faults PY - 2024 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-601576 DO - https://doi.org/10.1016/j.msea.2024.146690 SN - 0921-5093 VL - 907 SP - 1 EP - 16 PB - Elsevier B.V. AN - OPUS4-60157 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Nawaz, Q. A1 - Blaeß, Carsten A1 - Mueller, Ralf A1 - Boccaccini, A.R. T1 - Processing and cytocompatibility of Cu-doped and undoped fluoride-containing bioactive glasses N2 - Sintered or additive-manufactured bioactive glass (BG) scaffolds are highly interesting for bone replacement applications. However, crystallization often limits the high-temperature processability of bioactive glasses (BGs). Thus, the BG composition must combine high bioactivity and processability. In this study, three BGs with nominal molar (%) compositions 54.6SiO2-1.7P2O3-22.1CaO-6.0Na2O-7.9K2O-7.7MgO (13–93), 44.8SiO2-2.5P2O3-36.5CaO-6.6Na2O-6.6K2O-3.0CaF2 (F3) and 44.8SiO2-2.5P2O3-35.5CaO-6.6Na2O-6.6K2O-3.0CaF2-1.0CuO (F3–Cu) were investigated. The dissolution and ion release kinetics were investigated on milled glass powder and crystallized particles (500–600 μm). All glasses showed the precipitation of hydroxyapatite (HAp) crystals after 7 days of immersion in simulated body fluid. No significant differences in ion release from glass and crystalline samples were detected. The influence of surface roughness on cytocompatibility and growth of preosteoblast cells (MC3T3-E1) was investigated on sintered and polished BG pellets. Results showed that sintered BG pellets were cytocompatible, and cells were seen to be well attached and spread on the surface after 5 days of incubation. The results showed an inverse relation of cell viability with the surface roughness of pellets, and cells were seen to attach and spread along the direction of scratches. KW - Bioactive glass KW - Crystallization KW - Solubility KW - Cytocompatibility KW - Surface roughness PY - 2024 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-598257 DO - https://doi.org/10.1016/j.oceram.2024.100586 SN - 2666-5395 VL - 18 SP - 1 EP - 8 PB - Elsevier Ltd. AN - OPUS4-59825 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Kingsbery, P. A1 - Manzoni, Anna M. A1 - Suarez Ocaño, Patricia A1 - Többens, D. M. A1 - Stephan‐Scherb, C. T1 - High‐temperature KCl‐induced corrosion of high Cr and Ni alloys investigated by in‐situ diffraction N2 - High‐temperature KCl‐induced corrosion in laboratory air was observed in situ utilizing X‐ray diffraction. High Cr‐containing model alloys (Fe‐13Cr, Fe‐18Cr‐12Ni, and Fe‐25Cr‐20Ni) were coated with KCl and exposed to dry air at 560°C. KCl‐free alloys were studied in the equivalent atmosphere as a reference. After exposure to KCl‐free environments, all alloys showed the formation of very thin oxide layers, indicating good corrosion resistance. In contrast, KCl‐bearing alloys showed distinct damage after exposure. KW - Corrosion KW - In-situ diffraction KW - High-temperature corrosion PY - 2024 UR - https://nbn-resolving.org/urn:nbn:de:kobv:b43-600831 DO - https://doi.org/10.1002/maco.202314224 SN - 0947-5117 SP - 1 EP - 10 PB - Wiley VHC-Verlag AN - OPUS4-60083 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Schröder, Jakob A1 - Evans, Alexander A1 - Heldmann, A. A1 - Hofmann, M. A1 - Polatidis, E. A1 - Čapek, J. A1 - Petry, W. A1 - Serrano-Munoz, Itziar A1 - Bruno, Giovanni T1 - Diffraction and Single-Crystal Elastic Constants of Laser Powder Bed Fused Inconel 718 N2 - Laser powder bed fusion (PBF-LB/M) of metallic alloys is a layer-wise additive manufacturing process that provides significant scope for more efficient designs of components, benefiting performance and weight, leading to efficiency improvements for various sectors of industry. However, to benefit from these design freedoms, knowledge of the high produced induced residual stress and mechanical property anisotropy associated with the unique microstructures is critical. X-ray and neutron diffraction are considered the benchmark for non-destructive characterization of surface and bulk internal residual stress. The latter, characterized by the high penetration power in most engineering alloys, allows for the use of a diffraction angle close to 90° enabling a near cubic sampling volume to be specified. However, the complex microstructures of columnar growth with inherent crystallographic texture typically produced during PBF-LB/M of metallics present significant challenges to the assumptions typically required for time efficient determination of residual stress. These challenges include the selection of an appropriate set of diffraction elastic constants and a representative lattice plane suitable for residual stress analysis. In this contribution, the selection of a suitable lattice plane family for residual stress analysis is explored. Furthermore, the determination of an appropriate set of diffraction and single-crystal elastic constants depending on the underlying microstructure is addressed. In-situ loading experiments have been performed at the Swiss Spallation Neutron Source with the main scope to study the deformation behaviour of laser powder bed fused Inconel 718. Cylindrical tensile bars have been subjected to an increasing mechanical load. At pre-defined steps, neutron diffraction data has been collected. After reaching the yield limit, unloads have been performed to study the accumulation of intergranular strain among various lattice plane families. T2 - 11th European Conference on Residual Stresses CY - Prag, Czech Republic DA - 03.06.2024 KW - Additive Manufacturing KW - Laser Powder Bed fusion KW - Diffraction Elastic Constants KW - Microstructure KW - Electron Backscatter Diffraction PY - 2024 AN - OPUS4-60289 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Schröder, Jakob A1 - Evans, Alexander A1 - Luzin, V. A1 - Čapek, J. A1 - Polatidis, E. A1 - Bruno, Giovanni T1 - Laser Powder Bed Fusion: Fundamentals of Diffraction-Based Residual Stress Determination N2 - The general term additive manufacturing (AM) encompasses processes that enable the production of parts in a single manufacturing step. Among these, laser powder bed fusion (PBF-LB) is one of the most commonly used to produce metal components. In essence, a laser locally melts powder particles in a powder bed layer-by-layer to incrementally build a part. As a result, this process offers immense manufacturing flexibility and superior geometric design capabilities compared to conventional processes. However, these advantages come at a cost: the localized processing inevitably induces large thermal gradients, resulting in the formation of large thermal stress during manufacturing. In the best case, residual stress remains in the final parts produced as a footprint of this thermal stress. Since residual stress is well known to exacerbate the structural integrity of components, their assessment is important in two respects. First, to optimize process parameter to minimize residual stress magnitudes. Second, to study their effect on the structural integrity of components (e.g., validation of numerical models). Therefore, a reliable experimental assessment of residual stress is an important factor for the successful application of PBF-LB. In this context, diffraction-based techniques allow the non-destructive characterization of the residual stress. In essence, lattice strain is calculated from interplanar distances by application of Braggs law. From the known lattice strain, macroscopic stress can be determined using Hooke’s law. To allow the accurate assessment of the residual stress distribution by such methods, a couple of challenges in regard of the characteristic PBF-LB microstructures need to be overcome. This presentation highlights some of the challenges regarding the accurate assessment of residual stress in PBF-LB on the example of the Nickel-based alloy Inconel 718. The most significant influencing factors are the use of the correct diffraction elastic constants, the choice of the stress-free reference, and the consideration of the crystallographic texture. Further, it is shown that laboratory X-ray diffraction methods characterizing residual stress at the surface are biased by the inherent surface roughness. Overall, the impact of the characteristic microstructure is most significant for the selection of the correct diffraction elastic constants. In view of the localized melting and solidification, no significant gradients of the stress-free reference are observed, even though the cell-like solidification sub-structure is known to be heterogeneous on the micro-scale. T2 - 4th Symposium on Materials and Additive Manufacturing CY - Berlin, Germany DA - 12.06.2024 KW - Additive Manufacturing KW - Residual Stress KW - Electron Backscatter Diffraction KW - Laser Powder Bed Fusion PY - 2024 AN - OPUS4-60294 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Reinsch, Stefan A1 - Müller, Ralf T1 - Oriented Surface Crystallization in Glasses N2 - Up to now, oriented surface crystallization phenomena are discussed controversially, and related studies are restricted to few glasses. For silicate glasses we found a good correlation between the calculated surface energy of crystal faces and oriented surface nucleation. Surface energies were estimated assuming that crystal surfaces resemble minimum energy crack paths along the given crystal plane. This concept was successfully applied at the Institute of Physics of Rennes in calculating fracture surface energies of glasses. Several oriented nucleation phenomena can be herby explained assuming that high energy crystal surfaces tend to be wetted by the melt. This would minimize the total interfacial energy of the nucleus. Furthermore, we will discuss the evolution of the microstructure and its effect on the preferred crystal orientation. T2 - ACerS GOMD 2024- Glass & Optical Materials Division Meeting CY - Las Vegas, NV, USA DA - 19.05.2024 KW - Surface nucleation KW - Oriented surface crystallization KW - Surface energy PY - 2024 AN - OPUS4-60238 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Blaeß, Carsten A1 - Müller, Ralf T1 - Undesired Foaming of Silicate Glass Powders N2 - The manufacture of sintered glasses and glass-ceramics, glass matrix composites, and glass-bounded ceramics or pastes is often affected by un-expected gas bubble formation also named foaming. Against this background, in this presentation the main aspects and possible reasons of foaming are shown for completely different glass powders: a barium silicate glass powders used as SOFC sealants, and bioactive glass powders using different powder milling procedures. Sintering and foaming were measured by means of heating microscopy backed up by XRD, differential thermal analysis (DTA), vacuum hot extraction (VHE), optical and electron microscopy, and infrared spectroscopy, and time-of-flight secondary ion mass spectrometry (ToF-SIMS). Different densification was reached followed by significant foaming starting partly immediately, partly at higher temperature. Foaming increased significantly as milling progressed. For moderately milled glass powders, subsequent storage in air could also promote foaming. Although the milling atmosphere significantly affects the foaming of uniaxially pressed powder compacts sintered in air. VHE studies show that foaming is driven by carbon gases and carbonates were detected by Infrared spectroscopy to provide the major foaming source. Carbonates could be detected even after heating to 750 °C, which hints on a thermally very stable species or mechanical trapping or encapsulating of CO2. Otherwise, dark gray compact colors for milling in isopropanol indicate the presence of residual carbon as well. Its significant contribution to foaming, however, could not be proved and might be limited by the diffusivity of oxygen needed for carbon oxidation to carbon gas. T2 - Seminário de Laboratório de Materiais Vítreos (LaMaV) de Departamento de Engenharia de Materiais (DEMa), Universidade Federal São Carlos UFSCar) CY - Saint Charles, Brazil DA - 06.06.2024 KW - Bioactive KW - Foaming KW - Glass KW - Crystallization KW - Viscose sintering PY - 2024 AN - OPUS4-60245 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Reinsch, Stefan A1 - Müller, Ralf T1 - Orientierte Oberflächenkristallisation in Gläsern N2 - Bislang wird das Phänomen der orientierten Oberflächenkristallisation kontrovers diskutiert und entsprechende Studien beschränken sich auf nur wenige Gläser. Für Silikatgläser haben wir eine gute Korrelation zwischen der berechneten Oberflächenenergie von Kristallflächen und der orientierten Oberflächenkeimbildung gefunden. Die Oberflächenenergien wurden unter der Annahme abgeschätzt, dass die Kristalloberflächen bei der Keimbildung den Kristallebenen mit minimaler Energie entsprechen, denen ein Riss beim Bruch folgt. Dieses Konzept wurde am Institut für Physik in Rennes erfolgreich bei der Berechnung der Bruchflächenenergien von Gläsern angewandt. Mehrere orientierte Keimbildungsphänomene lassen sich dadurch erklären, dass man annimmt, dass Kristalloberflächen mit hoher Energie dazu neigen, von der Schmelze benetzt zu werden. Dies minimiert die gesamte Grenzflächenenergie des Keims. Darüber hinaus werden wir die Entwicklung der Mikrostruktur beim weiteren Kristallwachstum und ihre Auswirkungen auf die bevorzugte Kristallorientierung diskutieren. T2 - 21. Treffen des DGG-DKG Arbeitskreises „Glasig-kristalline Multifunktionswerkstoffe“ CY - Mainz, Germany DA - 22.02.2024 KW - Oberflächenkeimbildung KW - Kristallorientierung KW - Grenzflächenenergie PY - 2024 AN - OPUS4-60237 LA - mul AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Pavasarytė, Lina A1 - Azevedo do Nascimento, Allana A1 - Cysne Barbosa, Ana Paula A1 - Trappe, Volker A1 - Melo, Daniel T1 - Effects of particle size and particle concentration of poly (ethylene-co-methacrylic acid) on properties of epoxy resin N2 - Self-healing polymers have been developed to improve durability and reduce costs associated with maintenance during service. The addition of thermoplastics to thermosets to produce mendable polymers appears as a promising selfhealing technique. In this study, poly (ethylene-co-methacrylic acid) (EMAA) was added to epoxy resin and the effects of EMAA addition on epoxy properties were evaluated. Specimens with two different contents of thermoplastic and particles sizes were manufactured. A two-level full factorial experimental design was used to evaluate the effect of particle size and particle content on properties of epoxy modified with addition of EMAA. Tensile tests and dynamic mechanical analysis (DMA) were used and the evaluated responses were tensile strength, modulus of elasticity, and glass transition temperature (Tg). X-ray computed tomography (XCT) was used to investigate particle size and concentration after manufacturing. It was found that the particle concentration has greater effects on stress–strain behavior of epoxy while Tg was not significantly affected by neither of the analyzed entrance variables. KW - Fracture KW - Self-healing KW - Epoxy KW - Thermoplastic PY - 2024 DO - https://doi.org/10.1002/app.55677 SN - 0021-8995 SP - 1 EP - 14 PB - Wiley online library AN - OPUS4-60205 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Bayerlein, Bernd A1 - Schilling, Markus A1 - Waitelonis, Jörg A1 - v. Hartrott, Phillip A1 - Hanke, Thomas A1 - Birkholz, Henk A1 - Lau, June A1 - Skrotzki, Birgit T1 - Adapting FAIR Practices in Materials Science: Digital Representation of Material-Specific Characterization Methods N2 - Age-hardenable aluminum alloys undergo precise heat treatments to yield nanometer-sized precipitates that increase their strength and durability by hindering the dislocation mobility. Tensile tests provide mechanical properties, while microstructure evaluation relies on transmission electron microscopy (TEM), specifically the use of dark-field TEM images for precise dimensional analysis of the precipitates. However, this manual process is time consuming, skill dependent, and prone to errors and reproducibility issues. Our primary goal is to digitally represent these processes while adhering to FAIR principles. Ontologies play a critical role in facilitating semantic annotation of (meta)data and form the basis for advanced data management. Publishing raw data, digital workflows, and ontologies ensures reproducibility. This work introduces innovative solutions to traditional bottlenecks and offers new perspectives on digitalization challenges in materials science. We support advanced data management by leveraging knowledge graphs and foster collaborative and open data ecosystems that potentially revolutionize materials research and discovery. T2 - TMS - Specialty Congress 2024 CY - Cleveland, Ohio, US DA - 16.06.2024 KW - FAIR KW - Research Data Management KW - Semantic Interoperability KW - Ontologies KW - Materials and Processes Data Reusability PY - 2024 AN - OPUS4-60375 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Bayerlein, Bernd A1 - Schilling, Markus A1 - Birkholz, Henk T1 - Digital Transformation in Materials Science: Insights From the Platform MaterialDigital (PMD) N2 - The digital era has led to a significant increase in innovation in scientific research across diverse fields and sectors. Evolution of data-driven methodologies lead to a number of paradigm shifts how data, information, and knowledge is produced, understood, and analyzed. High profile paradigm shifts in the field of materials science (MS) include exploitative usage of computational tools, machine learning algorithms, and high-performance computing, which unlock novel avenues for investigating materials. In these presentations, we highlight prototype solutions developed in the context of the Platform MaterialDigital (PMD) project that addresses digitalization challenges. As part of the Material Digital Initiative, the PMD supports the establishment of a virtual materials data space and a systematic handling of hierarchical processes and materials data using a developed ontological framework as high priority work items. In particular, the mid-level ontology PMDco and its augmentation through application-specific ontologies are illustrated. As part of the conclusion, a discussion encompasses the evolutionary path of the ontological framework, taking into account standardization efforts and the integration of modern AI methodologies such as natural language processing (NLP). Moreover, demonstrators illustrated in these presentations highlight: The integration and interconnection of tools, such as digital workflows and ontologies, Semantic integration of diverse data as proof of concept for semantic interoperability, Improved reproducibility in image processing and analysis, and Seamless data acquisition pipelines supported by an ontological framework. In this context, concepts regarding the application of modern research data management tools, such as electronic laboratory notebooks (ELN) and laboratory information management systems (LIMS), are presented and elaborated on. Furthermore, the growing relevance of a standardized adoption of such technologies in the future landscape of digital initiatives is addressed. This is supposed to provide an additional basis for discussion with respect to possible collaborations. T2 - NIST Seminar on Digital Transformation CY - Gaithersburg, MD, USA DA - 11.06.2024 KW - Digital Transformation KW - Research Data Management KW - Ontology KW - Reusability KW - FAIR PY - 2024 AN - OPUS4-60381 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Bayerlein, Bernd A1 - Schilling, Markus A1 - Birkholz, Henk A1 - Jung, Matthias A1 - Waitelonis, Jörg A1 - Mädler, Lutz A1 - Sack, Harald T1 - PMD core ontology: Building Bridges at the Mid-Level – A Community Effort for Achieving Semantic Interoperability in Materials Science N2 - Knowledge representation in the materials science and engineering (MSE) domain is a vast and multi-faceted challenge: Overlap, ambiguity, and inconsistency in terminology are common. Invariant and variant knowledge are difficult to align cross-domain. Generic top-level semantic terminology often is too abstract, while MSE domain terminology often is too specific. This poster presents an approach to create and maintain a comprehensive and intuitive MSE-centric terminology by developing a mid-level ontology–the PMD core ontology (PMDco)–via MSE community-based curation procedures. The PMDco is designed in direct support of the FAIR principles to address immediate needs of the global experts community and their requirements. The illustrated findings show how the PMDco bridges semantic gaps between high-level, MSE-specific, and other science domain semantics, how the PMDco lowers development and integration thresholds, and how to fuel it from real-world data sources ranging from manually conducted experiments and simulations as well as continuously automated industrial applications. T2 - TMS - Specialty Congress 2024 CY - Cleveland, Ohio, US DA - 16.06.2024 KW - Interoperability KW - Semantic Interoperability KW - Digtial Representation KW - Knowledge graph and ontologies PY - 2024 AN - OPUS4-60378 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Schilling, Markus A1 - Bayerlein, Bernd A1 - Bruns, S. A1 - Birkholz, H. A1 - von Hartrott, P. A1 - Waitelonis, J. A1 - Lau, J. W. A1 - Skrotzki, Birgit T1 - Transforming Materials Science with ontologies, ELN, and LIMS: Semantic Web Solutions for Digitalization and Data Excellence N2 - Following the new paradigm of materials development, design and optimization, digitalization is the main goal in materials sciences (MS) which imposes a huge challenge. In this respect, the quality assurance of processes and output data as well as the interoperability between applications following FAIR (findability, accessibility, interoperability, reusability) principles are to be ensured. For storage, processing, and querying of data in contextualized form, Semantic Web Technologies (SWT) are used since they allow for machine-understandable and human-readable knowledge representations needed for data management, retrieval, and (re)use. The project ‘platform MaterialDigital’ (PMD) is part of an initiative that aims to bring together and support interested parties from both industrial and academic sectors in a sustainable manner in solving digitalization tasks and implementing digital solutions. Therefore, the establishment of a virtual material data space and the systematization of the handling of hierarchical, process-dependent material data are focused. Core points to be dealt with are the development of agreements on data structures and interfaces implemented in distinct software tools and to offer users specific added values in their projects. Furthermore, the platform contributes to a standardized description of data processing methods in materials research. In this respect, selected MSE methods are ontologically represented which are supposed to serve as best practice examples with respect to knowledge representation and the creation of knowledge graphs used for material data. Accordingly, this presentation shows the efforts taken within the PMD project to store data in accordance with a testing standard compliant ontological representation of a tensile test of metals at room temperature (ISO 6892-1:2019-11). This includes the path from developing an ontology in accordance with the respective standard up to connecting the ontology and data. The semantic connection of the ontology and data leads to interoperability and an enhanced ability of querying. For further enhanced reusability of data and knowledge from synthesis, production, and characterization of materials, the PMD core ontology (PMDco) was developed as mid-level ontology in the field of MSE. The semantic connection of the tensile test ontology (TTO) to the PMDco leads to enhanced expressivity and interoperability. Moreover, as a best practice example, generation and acquisition of test data semantically connected to the ontology (data mapping) was realized by applying an electronic laboratory notebook (ELN). Corresponding tensile tests were performed by materials science students at university. This enabled a fully digitally integrated experimental procedure that can be transferred to other test series and experiments. In addition to facilitating the acquisition, analysis, processing, and (re)usability of data, this also raises the awareness of students with respect to data structuring and semantic technologies in the sense of education and training. The entire data pipeline is further seamlessly integrable in a laboratory information management system (LIMS). More specifically, the integration of semantic conceptualization and knowledge graphs may become essential parts in LIMS as this would be very beneficial. Therefore, some first approaches of SWT integration in LIMS will also be presented briefly. T2 - TMS Specialty Congress 2024 CY - Cleveland, OH, USA DA - 16.06.2024 KW - Semantic Data KW - Plattform Material Digital KW - Tensile Test Ontology KW - Electronic Lab Notebook KW - Material Life Cycle PY - 2024 AN - OPUS4-60394 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Schilling, Markus A1 - Bayerlein, Bernd A1 - Birkholz, H. T1 - Digital Transformation in Materials Science: Insights from Platform MaterialDigital (PMD), Tensile Test Ontology (TTO), Electronic Lab Notebooks (ELN) N2 - The digital era has led to a significant increase in innovation in scientific research across diverse fields and sectors. Evolution of data-driven methodologies lead to a number of paradigm shifts how data, information, and knowledge is produced, understood, and analyzed. High profile paradigm shifts in the field of materials science (MS) include exploitative usage of computational tools, machine learning algorithms, and high-performance computing, which unlock novel avenues for investigating materials. In these presentations, we highlight prototype solutions developed in the context of the Platform MaterialDigital (PMD) project that addresses digitalization challenges. As part of the Material Digital Initiative, the PMD supports the establishment of a virtual materials data space and a systematic handling of hierarchical processes and materials data using a developed ontological framework as high priority work items. In particular, the mid-level ontology PMDco and its augmentation through application-specific ontologies are illustrated. As part of the conclusion, a discussion encompasses the evolutionary path of the ontological framework, taking into account standardization efforts and the integration of modern AI methodologies such as natural language processing (NLP). Moreover, demonstrators illustrated in these presentations highlight: The integration and interconnection of tools, such as digital workflows and ontologies, Semantic integration of diverse data as proof of concept for semantic interoperability, Improved reproducibility in image processing and analysis, and Seamless data acquisition pipelines supported by an ontological framework. In this context, concepts regarding the application of modern research data management tools, such as electronic laboratory notebooks (ELN) and laboratory information management systems (LIMS), are presented and elaborated on. Furthermore, the growing relevance of a standardized adoption of such technologies in the future landscape of digital initiatives is addressed. This is supposed to provide an additional basis for discussion with respect to possible collaborations. T2 - NIST Seminar Series CY - Gaithersburg, MD, USA DA - 11.06.2024 KW - Semantic Data KW - Plattform Material Digital KW - Digitalization KW - Data Interoperability KW - NIST KW - Tensile Test Ontology KW - Elctronic Lab Notebook PY - 2024 AN - OPUS4-60392 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER -