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The Journal of Physical Chemistry. A|March 19, 2020
Semiclassical Dispersion Corrections Efficiently Improve Multiconfigurational Theory with Short-Range Density-Functional Dynamic CorrelationChristopher J Stein, Markus ReiherJournal of Computational Chemistry|June 8, 2019
autoCAS: A Program for Fully Automated Multiconfigurational CalculationsChristopher J Stein, Markus ReiherChimia|April 28, 2017
Automated Identification of Relevant Frontier Orbitals for Chemical Compounds and ProcessesChristopher J Stein, Markus ReiherJournal of Chemical Theory and Computation|March 10, 2016
Automated Selection of Active Orbital SpacesChristopher J Stein, Markus ReiherJournal of Chemical Theory and Computation|July 14, 2016
The Delicate Balance of Static and Dynamic Electron CorrelationChristopher J Stein, Vera von Burg, Markus ReiherThe Journal of Chemical Physics|March 10, 2019
Optimization of highly excited matrix product states with an application to vibrational spectroscopyAlberto Baiardi, Christopher J Stein, Vincenzo Barone, et al.Journal of Chemical Theory and Computation|July 6, 2017
Vibrational Density Matrix Renormalization GroupAlberto Baiardi, Christopher J Stein, Vincenzo Barone, et al.Photochemistry and Photobiology|May 14, 2017
Quantum Chemical Spin Densities for Radical Cations of Photosynthetic Pigment ModelsDenis G Artiukhin, Christopher J Stein, Markus Reiher, et al.Angewandte Chemie (International Ed. in English)|May 11, 2017
Cooperative Light-Activated Iodine and Photoredox Catalysis for the Amination of Csp3 -H BondsPeter Becker, Thomas Duhamel, Christopher J Stein, et al.Inorganic Chemistry|December 10, 2002
Theoretical study of the Fe(phen)(2)(NCS)(2) spin-crossover complex with reparametrized density functionalsMarkus ReiherPageof 27