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Schröder, “Virtual Characterization Lab: A python toolkit for material characterization from molecular dynamics,” vol. 61, no. 2. 2026.","mla":"Jamebozorgi, Vahid, and Christian Schröder. <i>Virtual Characterization Lab: A Python Toolkit for Material Characterization from Molecular Dynamics</i>. Vol. 61, no. 2, 2026.","short":"V. Jamebozorgi, C. Schröder, 61 (2026).","chicago":"Jamebozorgi, Vahid, and Christian Schröder. “Virtual Characterization Lab: A Python Toolkit for Material Characterization from Molecular Dynamics.” Verhandlungen Der Deutschen Physikalischen Gesellschaft , 2026.","apa":"Jamebozorgi, V., &#38; Schröder, C. (2026). Virtual Characterization Lab: A python toolkit for material characterization from molecular dynamics. Presented at the Frühjahrstagung der Deutschen Physikalischen Gesellschaft, Dresden."},"department":[{"_id":"103"}],"author":[{"id":"242086","full_name":"Jamebozorgi, Vahid","orcid":"0009-0005-5700-3549","last_name":"Jamebozorgi","first_name":"Vahid"},{"full_name":"Schröder, Christian","first_name":"Christian","last_name":"Schröder"}],"status":"public","date_updated":"2026-08-28T15:31:39Z","date_created":"2026-08-24T16:10:31Z","user_id":"220548","publication_identifier":{"eissn":["751-0522 "]},"language":[{"iso":"eng"}],"conference":{"end_date":"2026-03-13","location":"Dresden","name":"Frühjahrstagung der Deutschen Physikalischen Gesellschaft","start_date":"2026-03-08"},"research_group":[{"_id":"af778127-b366-11ed-bde2-daed2b8eafee","name":"Bielefelder Institut für Angewandte Materialforschung (BIfAM)"}],"project":[{"name":"Bielefelder Institut für Angewandte Materialforschung","_id":"f89a05bb-bcea-11ed-9442-ed382659bc06"}],"title":"Virtual Characterization Lab: A python toolkit for material characterization from molecular dynamics","series_title":"Verhandlungen der Deutschen Physikalischen Gesellschaft ","year":"2026","type":"conference_abstract","issue":"2","volume":61},{"year":"2026","type":"research_data","publisher":"Vahid Jamebozorgi, self-published","related_material":{"link":[{"url":"https://github.com/Vahid-jb/MultiBEST---Multiscale-Multiphase-Bridging-Experiment-and-Simulation-Toolkit","relation":"confirmation"}]},"research_group":[{"_id":"af778127-b366-11ed-bde2-daed2b8eafee","name":"Bielefelder Institut für Angewandte Materialforschung (BIfAM)"}],"keyword":["Atomistic simulation","EBSD","Mesh generation","Finite element methods","Image processing","Digital-twin","Multiscale modeling"],"title":"MultiBEST – Multiscale/Multiphase Bridging Experiment and Simulation Toolkit","project":[{"name":"Bielefelder Institut für Angewandte Materialforschung","_id":"f89a05bb-bcea-11ed-9442-ed382659bc06"}],"status":"public","date_updated":"2026-08-28T13:46:33Z","date_created":"2026-08-24T16:35:13Z","user_id":"242086","abstract":[{"lang":"eng","text":"Current simulation workflows overwhelmingly rely on idealized or implicit microstructures, which prevents true side‑by‑side comparison with experiments and slows methodological progress. Directly simulating experimentally identical samples—using atomistic and continuum models—is a critical yet largely unrealized step toward predictive, microstructure‑aware materials discovery. In this work, we introduce MultiBEST, a unified GUI‑based framework that constructs experimentally faithful atomistic and continuum models directly from 2D micrographs, EBSD data, or simple user sketches. The resulting continuum representations explicitly resolve grain boundaries as crystallography‑aware volumetric interfaces with distinct properties, enabling multiscale modelling that approaches atomistic‑level fidelity. MultiBEST delivers an end‑to‑end pipeline—from image processing to final model export—with tunable computational cost, from rapid prototyping to large‑scale simulations."}],"_id":"7120","citation":{"alphadin":"<span style=\"font-variant:small-caps;\">Jamebozorgi, Vahid</span> ; <span style=\"font-variant:small-caps;\">Quisbrok, Robin</span> ; <span style=\"font-variant:small-caps;\">Nasari, Amirbahador</span> ; <span style=\"font-variant:small-caps;\">Schröder, Christian</span>: <i>MultiBEST – Multiscale/Multiphase Bridging Experiment and Simulation Toolkit</i> : Vahid Jamebozorgi, self-published, 2026","mla":"Jamebozorgi, Vahid, et al. <i>MultiBEST – Multiscale/Multiphase Bridging Experiment and Simulation Toolkit</i>. Vahid Jamebozorgi, self-published, 2026.","ieee":"V. Jamebozorgi, R. Quisbrok, A. Nasari, and C. Schröder, <i>MultiBEST – Multiscale/Multiphase Bridging Experiment and Simulation Toolkit</i>. Vahid Jamebozorgi, self-published, 2026.","short":"V. Jamebozorgi, R. 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(2026). <i>MultiBEST – Multiscale/Multiphase Bridging Experiment and Simulation Toolkit</i>. 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It enables researchers to analyze crystallography and generate essential characterization data, including X-ray Diffraction (XRD), Selected Area Electron Diffraction (SAED), Vibrational Density of States (VDOS), and Infrared (IR) spectra, all within a single, intuitive graphical user interface (GUI). By integrating every step from initial structure preparation to final data visualization, the VCL accelerates materials discovery by making virtual characterization more efficient, accessible, and directly comparable to experimental results.","lang":"eng"}],"user_id":"242086","date_created":"2026-08-24T16:29:50Z","date_updated":"2026-08-28T13:46:22Z","status":"public"},{"keyword":["Kreislaufwirtschaft","Circular Economy","R-Prinzip","Design for R"],"project":[{"_id":"f89a05bb-bcea-11ed-9442-ed382659bc06","name":"Bielefelder Institut für Angewandte Materialforschung"}],"title":"Neun entscheidende Punkte","article_type":"review","year":"2026","publisher":"Carl Hanser Verlag","issue":"2","type":"journal_article","volume":116,"_id":"6598","intvolume":"       116","citation":{"bibtex":"@article{Kartelmeyer_Ries_2026, title={Neun entscheidende Punkte}, volume={116}, number={2}, journal={Kunststoffe}, publisher={Carl Hanser Verlag}, author={Kartelmeyer, Stephan and Ries, Angela}, year={2026}, pages={20–24} }","ama":"Kartelmeyer S, Ries A. 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Dies dürfte mittelfristig zu Wettbewerbsvorteilen führen. Ineinandergreifende Strategien bieten eine ganzheitliche Lösung.","lang":"ger"}],"language":[{"iso":"ger"}],"user_id":"71369"},{"department":[{"_id":"103"}],"author":[{"id":"242086","first_name":"Vahid","orcid":"0009-0005-5700-3549","last_name":"Jamebozorgi","full_name":"Jamebozorgi, Vahid"},{"full_name":"Rasim, Karsten","last_name":"Rasim","first_name":"Karsten"},{"orcid":"0000-0002-6391-6548","last_name":"Schröder","first_name":"Christian","full_name":"Schröder, Christian","orcid_put_code_url":"https://api.orcid.org/v2.0/0000-0002-6391-6548/work/186776094","id":"35809"}],"intvolume":"       258","_id":"5970","citation":{"short":"V. Jamebozorgi, K. Rasim, C. Schröder, Computational Materials Science 258 (2025).","alphadin":"<span style=\"font-variant:small-caps;\">Jamebozorgi, Vahid</span> ; <span style=\"font-variant:small-caps;\">Rasim, Karsten</span> ; <span style=\"font-variant:small-caps;\">Schröder, Christian</span>: Multiscale modelling of corrosion-induced intergranular strain in iron under alkaline conditions. In: <i>Computational Materials Science</i> Bd. 258, Elsevier BV (2025)","ieee":"V. Jamebozorgi, K. Rasim, and C. 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In: <i>Posterbeitrag auf der Deutsche Pflanzenschutztagung DPST, 07.10-10.10.2025; Braunschweig</i>, 2025","short":"T.P. Zimmermann, M.-J. Reuther, J. Brikmann, E. Beitzen-Heineke, M. Rostás, A. Ries, A. Patel, in: Posterbeitrag Auf Der Deutsche Pflanzenschutztagung DPST, 07.10-10.10.2025; Braunschweig, 2025.","ama":"Zimmermann TP, Reuther M-J, Brikmann J, et al. Extrusion als Basis für die kosteneffiziente Formulierung von Mikroorganismen für den Einsatz im biologischen Pflanzenschutz. In: <i>Posterbeitrag Auf Der Deutsche Pflanzenschutztagung DPST, 07.10-10.10.2025; Braunschweig</i>. ; 2025.","bibtex":"@inproceedings{Zimmermann_Reuther_Brikmann_Beitzen-Heineke_Rostás_Ries_Patel_2025, title={Extrusion als Basis für die kosteneffiziente Formulierung von Mikroorganismen für den Einsatz im biologischen Pflanzenschutz}, booktitle={Posterbeitrag auf der Deutsche Pflanzenschutztagung DPST, 07.10-10.10.2025; Braunschweig}, author={Zimmermann, Thomas Philipp   and Reuther, Mary-Joanna and Brikmann, Johannes and Beitzen-Heineke, Elisa and Rostás, Michael and Ries, Angela and Patel, Anant}, year={2025} }","apa":"Zimmermann, T. P., Reuther, M.-J., Brikmann, J., Beitzen-Heineke, E., Rostás, M., Ries, A., &#38; Patel, A. (2025). Extrusion als Basis für die kosteneffiziente Formulierung von Mikroorganismen für den Einsatz im biologischen Pflanzenschutz. In <i>Posterbeitrag auf der Deutsche Pflanzenschutztagung DPST, 07.10-10.10.2025; Braunschweig</i>.","chicago":"Zimmermann, Thomas Philipp  , Mary-Joanna Reuther, Johannes Brikmann, Elisa Beitzen-Heineke, Michael Rostás, Angela Ries, and Anant Patel. “Extrusion Als Basis Für Die Kosteneffiziente Formulierung von Mikroorganismen Für Den Einsatz Im Biologischen Pflanzenschutz.” In <i>Posterbeitrag Auf Der Deutsche Pflanzenschutztagung DPST, 07.10-10.10.2025; Braunschweig</i>, 2025."},"_id":"6265","language":[{"iso":"eng"}],"user_id":"263827","type":"conference","year":"2025","date_created":"2025-11-03T10:41:15Z","date_updated":"2026-03-17T15:29:28Z","publication":"Posterbeitrag auf der Deutsche Pflanzenschutztagung DPST, 07.10-10.10.2025; Braunschweig","status":"public"},{"publisher":"Hannover : Technische Informationsbibliothek","user_id":"263827","type":"research_data","doi":"10.34657/20176","year":"2025","date_created":"2025-10-14T13:30:52Z","date_updated":"2026-03-17T15:29:27Z","status":"public","title":"Verbundvorhaben Entwicklung holistischer Formulierungsverfahren für den biologischen Pflanzenschutz von Beerenobst (HOPE)","project":[{"_id":"f89a05bb-bcea-11ed-9442-ed382659bc06","name":"Bielefelder Institut für Angewandte Materialforschung"}],"author":[{"id":"256326","full_name":"Keil, Waldemar","first_name":"Waldemar","last_name":"Keil"},{"first_name":"Anant","last_name":"Patel","full_name":"Patel, Anant","id":"201870"}],"_id":"6234","citation":{"chicago":"Keil, Waldemar, and Anant Patel. <i>Verbundvorhaben Entwicklung Holistischer Formulierungsverfahren Für Den Biologischen Pflanzenschutz von Beerenobst (HOPE)</i>. Hannover : Technische Informationsbibliothek, 2025. <a href=\"https://doi.org/10.34657/20176\">https://doi.org/10.34657/20176</a>.","apa":"Keil, W., &#38; Patel, A. (2025). <i>Verbundvorhaben Entwicklung holistischer Formulierungsverfahren für den biologischen Pflanzenschutz von Beerenobst (HOPE)</i>. Hannover : Technische Informationsbibliothek. <a href=\"https://doi.org/10.34657/20176\">https://doi.org/10.34657/20176</a>","bibtex":"@book{Keil_Patel_2025, title={Verbundvorhaben Entwicklung holistischer Formulierungsverfahren für den biologischen Pflanzenschutz von Beerenobst (HOPE)}, DOI={<a href=\"https://doi.org/10.34657/20176\">10.34657/20176</a>}, publisher={Hannover : Technische Informationsbibliothek}, author={Keil, Waldemar and Patel, Anant}, year={2025} }","ama":"Keil W, Patel A. <i>Verbundvorhaben Entwicklung Holistischer Formulierungsverfahren Für Den Biologischen Pflanzenschutz von Beerenobst (HOPE)</i>. Hannover : Technische Informationsbibliothek; 2025. doi:<a href=\"https://doi.org/10.34657/20176\">10.34657/20176</a>","alphadin":"<span style=\"font-variant:small-caps;\">Keil, Waldemar</span> ; <span style=\"font-variant:small-caps;\">Patel, Anant</span>: <i>Verbundvorhaben Entwicklung holistischer Formulierungsverfahren für den biologischen Pflanzenschutz von Beerenobst (HOPE)</i> : Hannover : Technische Informationsbibliothek, 2025","ieee":"W. Keil and A. Patel, <i>Verbundvorhaben Entwicklung holistischer Formulierungsverfahren für den biologischen Pflanzenschutz von Beerenobst (HOPE)</i>. Hannover : Technische Informationsbibliothek, 2025.","mla":"Keil, Waldemar, and Anant Patel. <i>Verbundvorhaben Entwicklung Holistischer Formulierungsverfahren Für Den Biologischen Pflanzenschutz von Beerenobst (HOPE)</i>. Hannover : Technische Informationsbibliothek, 2025, doi:<a href=\"https://doi.org/10.34657/20176\">10.34657/20176</a>.","short":"W. Keil, A. Patel, Verbundvorhaben Entwicklung Holistischer Formulierungsverfahren Für Den Biologischen Pflanzenschutz von Beerenobst (HOPE), Hannover : Technische Informationsbibliothek, 2025."}}]
