Forschungsbericht 2023
Molekulardynamische Simulation weicher Materie M-EXK2
Leitung: Meißner, Robert
Institut auf TORE
Institutswebsite
Publikationen
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Reconstructing the infrared spectrum of a peptide from representative conformers of the full canonical ensemble - Journal Article
Kotobi, Amir; Schwob, Lucas; Vonbun-Feldbauer, Gregor; Rossi, Mariana; Gasparotto, Piero; Feiler, Christian; Berden, Giel; Oomens, Jos; Oostenrijk, Bart; Scuderi, Debora; Bari, Sadia; Meißner, Robert
Communications Chemistry 6 (1): 46 (2023-12)
Open Access | Publisher DOI
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Searching the chemical space for effective magnesium dissolution modulators: a deep learning approach using sparse features - Journal Article
Schiessler, Elisabeth J.; Würger, Tim; Vaghefinazari, Bahram; Lamaka, Sviatlana V.; Meißner, Robert; Cyron, Christian J.; Zheludkevich, Mikhail L.; Feiler, Christian; Aydin, Roland
npj Materials Degradation 7 (1): 74 (2023-12-01)
Open Access | Publisher DOI
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Deformation dynamics of nanopores upon water imbibition - Preprint
Sanchez Calzado, Juan; Dammann, Lars; Gallardo Domínguez, Laura; Li, Zhuoqing; Fröba, Michael; Meißner, Robert; Stone, Howard A.; Huber, Patrick
arXiv: 2311.13025 (2023)
Publisher DOI
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Integrating explainability into graph neural network models for the prediction of X-ray absorption spectra - Journal Article
Kotobi, Amir; Singh, Kanishka; Höche, Daniel; Bari, Sadia; Meißner, Robert; Bande, Annika
Journal of the American Chemical Society 145 (41): 22584-22598 (2023-10-09)
Publisher DOI
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Vibro-acoustic modulation based measurements in CFRP laminates for damage detection in Open-Hole structures - Journal Article
Willmann, Erik; Boll, Benjamin; Mikaelyan, Gor; Wittich, Hans; Meißner, Robert; Fiedler, Bodo
Composites Communications 42: 101659 (2023-10)
Publisher DOI
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Mapping the electronic transitions of protonation sites in peptides using soft X-ray action spectroscopy - Journal Article
Leroux, Juliette; Kotobi, Amir; Hirsch, Konstantin; Lau, Tobias; Ortiz Mahecha, Carlos; Maksimov, Dmitrii; Meißner, Robert; Oostenrijk, Bart; Rossi, Mariana; Schubert, Kaja; Timm, Martin; Trinter, Florian; Unger, Isaak; Zamudio-Bayer, Vicente; Schwob, Lucas; Bari, Sadia
Physical Chemistry Chemical Physics 25 (37): 25603-25618 (2023-09-18)
Open Access | Publisher DOI
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Orientation order of a nonpolar molecular fluid compressed into a nanosmall space - Journal Article
Wang, Dan; Lippmann, Milena; Gäding, Johannes; Ehnes, Anita; Novikov, Dmitri; Meißner, Robert; Seeck, Oliver H.
Nanoscale 15 (17): 8019-8028 (2023-04-12)
Publisher DOI
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Health monitoring of CFRP laminates under cyclic loading via vibro-acoustic modulation based measurements - Journal Article
Willmann, Erik; Boll, Benjamin; Scheel, Moritz; Meißner, Robert; Fiedler, Bodo
Composite Structures 308: 116696 (2023-03-15)
Publisher DOI
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Imbibition of water in nanoporous silica (MCM-41) - Book part
Dammann, Lars; Seeck, Oliver H.; Meißner, Robert; Huber, Patrick
In: Médici, E.F., Otero, A.D. (eds) Album of Porous Media. Springer, Cham, 2023.
Publisher DOI
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Oxidation-state dynamics and emerging patterns in magnetite - Journal Article
Gürsoy, Emre; Vonbun-Feldbauer, Gregor; Meißner, Robert
Journal of Physical Chemistry Letters 14 (30): 6800-6807 (2023)
Open Access | Publisher DOI
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Krümmungs-Kapazitäts-Beziehungen gewellter Elektroden in elektrochemischen Doppelschichtkondensatoren - Doctoral Thesis
Seebeck, Jannes
Technische Universität Hamburg (2023)
Open Access
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A computational approach to magnesium corrosion engineering - Doctoral Thesis
Würger, Tim
Dr. Hut 978-3-8439-5201-9: (2023)
Open Access
Projekte