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The Journal of Chemical Physics
|
June 7, 2011
Integrating steepest-descent reaction pathways for large molecules
Hrant P Hratchian, Michael J Frisch
The Journal of Physical Chemistry. A
|
July 26, 2011
Subshell fitting of relativistic atomic core electron densities for use in QTAIM analyses of ECP-based wave functions
Todd A Keith, Michael J Frisch
The Journal of Chemical Physics
|
July 5, 2011
Brueckner doubles coupled cluster method with the polarizable continuum model of solvation
Marco Caricato, Giovanni Scalmani, Michael J Frisch
The Journal of Chemical Physics
|
November 10, 2009
On the difference between the transition properties calculated with linear response- and equation of motion-CCSD approaches
Marco Caricato, Gary W Trucks, Michael J Frisch
The Journal of Chemical Physics
|
July 24, 2014
Practical auxiliary basis implementation of Rung 3.5 functionals
Benjamin G Janesko, Giovanni Scalmani, Michael J Frisch
Journal of Chemical Theory and Computation
|
December 15, 2015
Quantifying Electron Delocalization in Electrides
Benjamin G Janesko, Giovanni Scalmani, Michael J Frisch
Journal of Chemical Theory and Computation
|
December 1, 2015
A Comparison of Three Variants of the Generalized Davidson Algorithm for the Partial Diagonalization of Large Non-Hermitian Matrices
Marco Caricato, Gary W Trucks, Michael J Frisch
Journal of Chemical Theory and Computation
|
November 26, 2015
Projected Coupled Cluster Amplitudes from a Different Basis Set As Initial Guess
Marco Caricato, Gary W Trucks, Michael J Frisch
The Journal of Chemical Physics
|
October 17, 2014
How far do electrons delocalize?
Benjamin G Janesko, Giovanni Scalmani, Michael J Frisch
Physical Chemistry Chemical Physics : PCCP
|
May 22, 2015
Quantifying solvated electrons' delocalization
Benjamin G Janesko, Giovanni Scalmani, Michael J Frisch
Page
of 12
Search research articles
Search
Showing results (11-20 of 116) with videos related to
Sort By:
Page
of 12
The Journal of Chemical Physics
|
June 7, 2011
Integrating steepest-descent reaction pathways for large molecules
Hrant P Hratchian, Michael J Frisch
The Journal of Physical Chemistry. A
|
July 26, 2011
Subshell fitting of relativistic atomic core electron densities for use in QTAIM analyses of ECP-based wave functions
Todd A Keith, Michael J Frisch
The Journal of Chemical Physics
|
July 5, 2011
Brueckner doubles coupled cluster method with the polarizable continuum model of solvation
Marco Caricato, Giovanni Scalmani, Michael J Frisch
The Journal of Chemical Physics
|
November 10, 2009
On the difference between the transition properties calculated with linear response- and equation of motion-CCSD approaches
Marco Caricato, Gary W Trucks, Michael J Frisch
The Journal of Chemical Physics
|
July 24, 2014
Practical auxiliary basis implementation of Rung 3.5 functionals
Benjamin G Janesko, Giovanni Scalmani, Michael J Frisch
Journal of Chemical Theory and Computation
|
December 15, 2015
Quantifying Electron Delocalization in Electrides
Benjamin G Janesko, Giovanni Scalmani, Michael J Frisch
Journal of Chemical Theory and Computation
|
December 1, 2015
A Comparison of Three Variants of the Generalized Davidson Algorithm for the Partial Diagonalization of Large Non-Hermitian Matrices
Marco Caricato, Gary W Trucks, Michael J Frisch
Journal of Chemical Theory and Computation
|
November 26, 2015
Projected Coupled Cluster Amplitudes from a Different Basis Set As Initial Guess
Marco Caricato, Gary W Trucks, Michael J Frisch
The Journal of Chemical Physics
|
October 17, 2014
How far do electrons delocalize?
Benjamin G Janesko, Giovanni Scalmani, Michael J Frisch
Physical Chemistry Chemical Physics : PCCP
|
May 22, 2015
Quantifying solvated electrons' delocalization
Benjamin G Janesko, Giovanni Scalmani, Michael J Frisch
Page
of 12