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Physical Chemistry Chemical Physics : PCCP|September 17, 2013
Understanding the evaporation of ionic liquids using the example of 1-ethyl-3-methylimidazolium ethylsulfateFriedrich Malberg, Martin Brehm, Oldamur Hollóczki, et al.Journal of Chemical Theory and Computation|December 30, 2020
Efficient EOM-CC-based Protocol for the Calculation of Electron Affinity of Solvated Nucleobases: Uracil as a Case StudyMadhubani Mukherjee, Divya Tripathi, Martin Brehm, et al.Journal of Computational Chemistry|February 18, 2017
Conformational Space of a Polyphilic Molecule with a Fluorophilic Side Chain Integrated in a DPPC BilayerGuido F von Rudorff, Tobias Watermann, Xiang-Yang Guo, et al.The Journal of Physical Chemistry Letters|April 27, 2017
Molecular Mechanism of Overhauser Dynamic Nuclear Polarization in Insulating SolidsSvetlana Pylaeva, Konstantin L Ivanov, Marc Baldus, et al.Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|March 3, 2012
Effect of dispersion on the structure and dynamics of the ionic liquid 1-ethyl-3-methylimidazolium thiocyanateAlfonso S Pensado, Martin Brehm, Jens Thar, et al.Journal of Chemical Information and Modeling|October 31, 2022
Cluster Analysis in Liquids: A Novel Tool in TRAVISTom Frömbgen, Jan Blasius, Vahideh Alizadeh, et al.The Journal of Chemical Physics|August 24, 2015
Nuclear velocity perturbation theory for vibrational circular dichroism: An approach based on the exact factorization of the electron-nuclear wave functionArne Scherrer, Federica Agostini, Daniel Sebastiani, et al.Physical Chemistry Chemical Physics : PCCP|April 29, 2014
Competition between excited state proton and OH(-) transport via a short water wire: solvent effects open the gateGül Bekçioğlu, Christoph Allolio, Maria Ekimova, et al.The Journal of Physical Chemistry. B|December 22, 2010
Performance of quantum chemically derived charges and persistence of ion cages in ionic liquids. A molecular dynamics simulations study of 1-n-butyl-3-methylimidazolium bromideMiriam Kohagen, Martin Brehm, Jens Thar, et al.JACS Au|January 2, 2023
Transferable Deep Learning Potential Reveals Intermediate-Range Ordering Effects in LiF-NaF-ZrF4 Molten SaltRajni Chahal, Santanu Roy, Martin Brehm, et al.Pageof 15