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Dmitrij Rappoport

Showing results (1-10 of 44) with videos related to

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Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|September 29, 2011
Basis-set quality and basis-set bias in molecular property calculationsDmitrij Rappoport
The Journal of Physical Chemistry. A|March 9, 2019
Reaction Networks and the Metric Structure of Chemical Space(s)Dmitrij Rappoport
The Journal of Chemical Physics|October 2, 2021
Property-optimized Gaussian basis sets for lanthanidesDmitrij Rappoport
The Journal of Physical Chemistry. A|June 7, 2023
Statistics and Bias-Free Sampling of Reaction Mechanisms from Reaction Network ModelsDmitrij Rappoport
The Journal of Chemical Physics|March 3, 2005
Analytical time-dependent density functional derivative methods within the RI-J approximation, an approach to excited states of large moleculesDmitrij Rappoport, Filipp Furche
The Journal of Chemical Physics|October 15, 2010
Property-optimized gaussian basis sets for molecular response calculationsDmitrij Rappoport, Filipp Furche
Physical Chemistry Chemical Physics : PCCP|October 8, 2009
Structure of endohedral fullerene Eu@C74Dmitrij Rappoport, Filipp Furche
Journal of the American Chemical Society|January 30, 2004
Photoinduced intramolecular charge transfer in 4-(dimethyl)aminobenzonitrile--a theoretical perspectiveDmitrij Rappoport, Filipp Furche
The Journal of Chemical Physics|June 8, 2007
Lagrangian approach to molecular vibrational Raman intensities using time-dependent hybrid density functional theoryDmitrij Rappoport, Filipp Furche
Physical Chemistry Chemical Physics : PCCP|November 21, 2014
Development of new auxiliary basis functions of the Karlsruhe segmented contracted basis sets including diffuse basis functions (def2-SVPD, def2-TZVPPD, and def2-QVPPD) for RI-MP2 and RI-CC calculationsArnim Hellweg, Dmitrij Rappoport
Pageof 5

Showing results (1-10 of 44) with videos related to

Sort By:
Pageof 5
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|September 29, 2011
Basis-set quality and basis-set bias in molecular property calculationsDmitrij Rappoport
The Journal of Physical Chemistry. A|March 9, 2019
Reaction Networks and the Metric Structure of Chemical Space(s)Dmitrij Rappoport
The Journal of Chemical Physics|October 2, 2021
Property-optimized Gaussian basis sets for lanthanidesDmitrij Rappoport
The Journal of Physical Chemistry. A|June 7, 2023
Statistics and Bias-Free Sampling of Reaction Mechanisms from Reaction Network ModelsDmitrij Rappoport
The Journal of Chemical Physics|March 3, 2005
Analytical time-dependent density functional derivative methods within the RI-J approximation, an approach to excited states of large moleculesDmitrij Rappoport, Filipp Furche
The Journal of Chemical Physics|October 15, 2010
Property-optimized gaussian basis sets for molecular response calculationsDmitrij Rappoport, Filipp Furche
Physical Chemistry Chemical Physics : PCCP|October 8, 2009
Structure of endohedral fullerene Eu@C74Dmitrij Rappoport, Filipp Furche
Journal of the American Chemical Society|January 30, 2004
Photoinduced intramolecular charge transfer in 4-(dimethyl)aminobenzonitrile--a theoretical perspectiveDmitrij Rappoport, Filipp Furche
The Journal of Chemical Physics|June 8, 2007
Lagrangian approach to molecular vibrational Raman intensities using time-dependent hybrid density functional theoryDmitrij Rappoport, Filipp Furche
Physical Chemistry Chemical Physics : PCCP|November 21, 2014
Development of new auxiliary basis functions of the Karlsruhe segmented contracted basis sets including diffuse basis functions (def2-SVPD, def2-TZVPPD, and def2-QVPPD) for RI-MP2 and RI-CC calculationsArnim Hellweg, Dmitrij Rappoport
Pageof 5