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Journal of Chemical Theory and Computation
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December 2, 2015
Performance of the Density Functional Theory/Multireference Configuration Interaction Method on Electronic Excitation of Extended π-Systems
Christel M Marian, Natalie Gilka
Physical Chemistry Chemical Physics : PCCP
|
May 23, 2009
Intersystem crossing driven by vibronic spin-orbit coupling: a case study on psoralen
Jörg Tatchen, Natalie Gilka, Christel M Marian
The Journal of Chemical Physics
|
August 7, 2008
Electron spin-spin coupling from multireference configuration interaction wave functions
Natalie Gilka, Peter R Taylor, Christel M Marian
The Journal of Chemical Physics
|
April 22, 2010
The resolution of the identity approximation for calculations of spin-spin contribution to zero-field splitting parameters
Dmitry Ganyushin, Natalie Gilka, Peter R Taylor, et al.
The Journal of Chemical Physics
|
November 17, 2015
Electronic spectrum of the propargyl cation (H2C3H(+)) tagged with Ne and N2
Katherine J Catani, Julian A Sanelli, Viktoras Dryza, et al.
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of 1
Search research articles
Search
Showing results (1-10 of 5) with videos related to
Sort By:
Page
of 1
Journal of Chemical Theory and Computation
|
December 2, 2015
Performance of the Density Functional Theory/Multireference Configuration Interaction Method on Electronic Excitation of Extended π-Systems
Christel M Marian, Natalie Gilka
Physical Chemistry Chemical Physics : PCCP
|
May 23, 2009
Intersystem crossing driven by vibronic spin-orbit coupling: a case study on psoralen
Jörg Tatchen, Natalie Gilka, Christel M Marian
The Journal of Chemical Physics
|
August 7, 2008
Electron spin-spin coupling from multireference configuration interaction wave functions
Natalie Gilka, Peter R Taylor, Christel M Marian
The Journal of Chemical Physics
|
April 22, 2010
The resolution of the identity approximation for calculations of spin-spin contribution to zero-field splitting parameters
Dmitry Ganyushin, Natalie Gilka, Peter R Taylor, et al.
The Journal of Chemical Physics
|
November 17, 2015
Electronic spectrum of the propargyl cation (H2C3H(+)) tagged with Ne and N2
Katherine J Catani, Julian A Sanelli, Viktoras Dryza, et al.
Page
of 1