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1456 Publications
2020 | Journal Article | LibreCat-ID: 25900 | 
Javed, Ali, Thorsten Wagner, Stephan Wöhlbrandt, Norbert Stock, and Michael Tiemann. “Proton Conduction in a Single Crystal of a Phosphonato‐Sulfonate‐Based Coordination Polymer: Mechanistic Insight.” ChemPhysChem, 2020, 605–9. https://doi.org/10.1002/cphc.202000102.
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2020 | Journal Article | LibreCat-ID: 25902 |
Weinberger, Christian, and Michael Tiemann. “Functional Nanoporous Materials.” Nanomaterials, 2020. https://doi.org/10.3390/nano10040699.
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2020 | Journal Article | LibreCat-ID: 43747 |
Meier, Torsten, Xuekai Ma, Bernd Berger, Marc Aßmann, Rodislav Driben, Christian Schneider, Sven Höfling, and Stefan Schumacher. “Realization of All-Optical Vortex Switching in Exciton-Polariton Condensates.” Nature Communications 11, no. 1 (2020): 897. https://doi.org/10.1038/s41467-020-14702-5.
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2020 | Conference Paper | LibreCat-ID: 42892
Wübbeke, Andrea, Volker Schöppner, André Paul, Michael Tiemann, Laura Austermeier, Marcus Fitze, Mingie Chen, et al. “Long- and Short-Term Tensile Strength and Morphology of Joined Beta-Nucleated Polypropylene Parts.” In SPE ANTEC 2020: The Virtual Edition 5 , 2020.
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2020 | Journal Article | LibreCat-ID: 24236
Schöppner, Volker, Andrea Wübbeke, Fabian Schriegel, Andrej Paul, Michael Tiemann, Bastian Geißler, Michael Schmidt, Arnaud Magnier, and Thomas Niendorf. “Selected Aspects for the Assessment of Laser Transmission Welding.” Joining Plastics, 2020, 30–35.
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2020 | Journal Article | LibreCat-ID: 44995
Dreßler, C., G. Kabbe, Martin Brehm, and D. Sebastiani. “Exploring Non-Equilibrium Molecular Dynamics of Mobile Protons in the Solid Acid CsH2PO4 on the Micrometer and Microsecond Scale.” J. Chem. Phys. 152 (16) (2020): 164110. https://doi.org/10.1063/5.0002167.
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2020 | Journal Article | LibreCat-ID: 44997
Brehm, Martin, J. Radicke, M. Pulst, F. Shaabani, D. Sebastiani, and J. Kressler. “Dissolving Cellulose in 1,2,3-Triazolium- and Imidazolium-Based Ionic Liquids with Aromatic Anions.” Molecules 25 (15) (2020): 3539. https://doi.org/10.3390/molecules25153539.
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2020 | Journal Article | LibreCat-ID: 44998
Hunold, J., J. Eisermann, Martin Brehm, and D. Hinderberger. “Characterization of Aqueous Lower Polarity Solvation Shells Around Amphiphilic TEMPO Radicals in Water.” J. Phys. Chem. B 124 (39) (2020): 8601–9. https://doi.org/10.1021/acs.jpcb.0c04863.
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2020 | Journal Article | LibreCat-ID: 44993
Scarbath-Evers, L., R. Hammer, D. Golze, Martin Brehm, D. Sebastiani, and W. Widdra. “From Flat to Tilted: Gradual Interfaces in Organic Thin Film Growth.” Nanoscale 12 (2020): 3834–45. https://doi.org/10.1039/C9NR06592J.
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2020 | Journal Article | LibreCat-ID: 44994
Dreßler, C., G. Kabbe, Martin Brehm, and D. Sebastiani. “Dynamical Matrix Propagator Scheme for Large-Scale Proton Dynamics Simulations.” J. Chem. Phys. 152 (11) (2020): 114114. https://doi.org/10.1063/1.5140635.
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2020 | Journal Article | LibreCat-ID: 44999
Weiß, M., and Martin Brehm. “Exploring Free Energy Profiles of Enantioselective Organocatalytic Aldol Reactions under Full Solvent Influence.” Molecules 25 (24) (2020): 5861. https://doi.org/10.3390/molecules25245861.
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2020 | Journal Article | LibreCat-ID: 44996
Brehm, Martin, M. Thomas, S. Gehrke, and B. Kirchner. “TRAVIS – A Free Analyzer for Trajectories from Molecular Simulation.” J. Chem. Phys. 152 (16) (2020): 164105. https://doi.org/10.1063/5.0005078.
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2020 | Journal Article | LibreCat-ID: 24100
Engelkemeier, Katja, Jörg Lindner, Julius Bürger, Kathrin Vaupel, Marc Hartmann, Michael Tiemann, Kay-Peter Hoyer, and Mirko Schaper. “Nano-Architectural Complexity of Zinc Oxide Nanowall Hollow Microspheres and Their Structural Properties.” Nanotechnology 31 (2020): 095701. https://doi.org/10.1088/1361-6528/ab55bc.
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2020 | Journal Article | LibreCat-ID: 16277 |
Kühne, Thomas, Marcella Iannuzzi, Mauro Del Ben, Vladimir V. Rybkin, Patrick Seewald, Frederick Stein, Teodoro Laino, et al. “CP2K: An Electronic Structure and Molecular Dynamics Software Package - Quickstep: Efficient and Accurate Electronic Structure Calculations.” The Journal of Chemical Physics 152, no. 19 (2020). https://doi.org/10.1063/5.0007045.
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2020 | Conference Paper | LibreCat-ID: 16898
Lass, Michael, Robert Schade, Thomas Kühne, and Christian Plessl. “A Submatrix-Based Method for Approximate Matrix Function Evaluation in the Quantum Chemistry Code CP2K.” In Proc. International Conference for High Performance Computing, Networking, Storage and Analysis (SC), 1127–40. Los Alamitos, CA, USA: IEEE Computer Society, 2020. https://doi.org/10.1109/SC41405.2020.00084.
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| arXiv
2020 | Preprint | LibreCat-ID: 40994
Bauer, Matthias, Jakob Steube, Ayla Päpcke, Olga Bokareva, Thomas Reuter, Serhiy Demeshko, Roland Schoch, et al. “Janus-Type Dual Emission of a Cyclometalated Iron(III) Complex.” Research Square Platform LLC, 2020.
LibreCat
2020 | Journal Article | LibreCat-ID: 12878 |
Rengaraj, Varadarajan, Michael Lass, Christian Plessl, and Thomas Kühne. “Accurate Sampling with Noisy Forces from Approximate Computing.” Computation 8, no. 2 (2020). https://doi.org/10.3390/computation8020039.
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| arXiv
2020 | Journal Article | LibreCat-ID: 41025
Prinz, Nils, Leif Schwensow, Sven Strübbe, Andreas Jentys, Matthias Bauer, Wolfgang Kleist, and Mirijam Zobel. “Hard X-Ray-Based Techniques for Structural Investigations of CO2 Methanation Catalysts Prepared by MOF Decomposition.” Nanoscale 12, no. 29 (2020): 15800–813. https://doi.org/10.1039/d0nr01750g.
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2020 | Journal Article | LibreCat-ID: 62101
Longwitz, Lars, and Thomas Werner. “Reduction of Activated Alkenes by PIII/PV Redox Cycling Catalysis.” Angewandte Chemie 132, no. 7 (2020): 2782–85. https://doi.org/10.1002/ange.201912991.
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2020 | Patent | LibreCat-ID: 62147
Werner, Thomas, V. Stefanow, A. Grandane, J. Panten, and M. Eh. “Novel Processes for Preparing Cis-Cedrandiol,” 2020.
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