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1456 Publications
2020 | Journal Article | LibreCat-ID: 25900 | 
Javed A, Wagner T, Wöhlbrandt S, Stock N, Tiemann M. Proton Conduction in a Single Crystal of a Phosphonato‐Sulfonate‐Based Coordination Polymer: Mechanistic Insight. ChemPhysChem. Published online 2020:605-609. doi:10.1002/cphc.202000102
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2020 | Journal Article | LibreCat-ID: 25902 |
Weinberger C, Tiemann M. Functional Nanoporous Materials. Nanomaterials. Published online 2020. doi:10.3390/nano10040699
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2020 | Journal Article | LibreCat-ID: 43747 |
Meier T, Ma X, Berger B, et al. Realization of all-optical vortex switching in exciton-polariton condensates. Nature communications. 2020;11(1):897. doi:10.1038/s41467-020-14702-5
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2020 | Conference Paper | LibreCat-ID: 42892
Wübbeke A, Schöppner V, Paul A, 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 V, Wübbeke A, Schriegel F, et al. Selected Aspects for the Assessment of Laser Transmission Welding. Joining Plastics. Published online 2020:30-35.
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2020 | Journal Article | LibreCat-ID: 44995
Dreßler C, Kabbe G, Brehm M, Sebastiani D. Exploring Non-Equilibrium Molecular Dynamics of Mobile Protons in the Solid Acid CsH2PO4 on the Micrometer and Microsecond Scale. J Chem Phys. 2020;152 (16):164110. doi:10.1063/5.0002167
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2020 | Journal Article | LibreCat-ID: 44997
Brehm M, Radicke J, Pulst M, Shaabani F, Sebastiani D, Kressler J. Dissolving Cellulose in 1,2,3-Triazolium- and Imidazolium-Based Ionic Liquids with Aromatic Anions. Molecules. 2020;25 (15):3539. doi:10.3390/molecules25153539
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2020 | Journal Article | LibreCat-ID: 44998
Hunold J, Eisermann J, Brehm M, Hinderberger D. Characterization of Aqueous Lower Polarity Solvation Shells Around Amphiphilic TEMPO Radicals in Water. J Phys Chem B. 2020;124 (39):8601-8609. doi:10.1021/acs.jpcb.0c04863
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2020 | Journal Article | LibreCat-ID: 44993
Scarbath-Evers L, Hammer R, Golze D, Brehm M, Sebastiani D, Widdra W. From Flat to Tilted: Gradual Interfaces in Organic Thin Film Growth. Nanoscale. 2020;12:3834-3845. doi:10.1039/C9NR06592J
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2020 | Journal Article | LibreCat-ID: 44994
Dreßler C, Kabbe G, Brehm M, Sebastiani D. Dynamical Matrix Propagator Scheme for Large-Scale Proton Dynamics Simulations. J Chem Phys. 2020;152 (11):114114. doi:10.1063/1.5140635
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2020 | Journal Article | LibreCat-ID: 44999
Weiß M, Brehm M. Exploring Free Energy Profiles of Enantioselective Organocatalytic Aldol Reactions under Full Solvent Influence. Molecules. 2020;25 (24):5861. doi:10.3390/molecules25245861
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2020 | Journal Article | LibreCat-ID: 44996
Brehm M, Thomas M, Gehrke S, Kirchner B. TRAVIS – A Free Analyzer for Trajectories from Molecular Simulation. J Chem Phys. 2020;152 (16):164105. doi:10.1063/5.0005078
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2020 | Journal Article | LibreCat-ID: 24100
Engelkemeier K, Lindner J, Bürger J, et al. Nano-architectural complexity of zinc oxide nanowall hollow microspheres and their structural properties. Nanotechnology. 2020;31:095701. doi:10.1088/1361-6528/ab55bc
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2020 | Journal Article | LibreCat-ID: 16277 |
Kühne T, Iannuzzi M, Ben MD, et al. CP2K: An electronic structure and molecular dynamics software package - Quickstep: Efficient and accurate electronic structure calculations. The Journal of Chemical Physics. 2020;152(19). doi:10.1063/5.0007045
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| arXiv
2020 | Conference Paper | LibreCat-ID: 16898
Lass M, Schade R, Kühne T, Plessl C. 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). IEEE Computer Society; 2020:1127-1140. doi:10.1109/SC41405.2020.00084
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| arXiv
2020 | Preprint | LibreCat-ID: 40994
Bauer M, Steube J, Päpcke A, et al. Janus-type dual emission of a Cyclometalated Iron(III) complex. Published online 2020.
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2020 | Journal Article | LibreCat-ID: 12878 |
Rengaraj V, Lass M, Plessl C, Kühne T. Accurate Sampling with Noisy Forces from Approximate Computing. Computation. 2020;8(2). doi:10.3390/computation8020039
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| arXiv
2020 | Journal Article | LibreCat-ID: 41025
Prinz N, Schwensow L, Strübbe S, et al. Hard X-ray-based techniques for structural investigations of CO2 methanation catalysts prepared by MOF decomposition. Nanoscale. 2020;12(29):15800-15813. doi:10.1039/d0nr01750g
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2020 | Journal Article | LibreCat-ID: 62101
Longwitz L, Werner T. Reduction of Activated Alkenes by PIII/PV Redox Cycling Catalysis. Angewandte Chemie. 2020;132(7):2782-2785. doi:10.1002/ange.201912991
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2020 | Patent | LibreCat-ID: 62147
Werner T, Stefanow V, Grandane A, Panten J, Eh M. Novel processes for preparing cis-cedrandiol. Published online 2020.
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