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The Journal of Chemical Physics
|
November 10, 2016
Analytic formulation of derivative coupling vectors for complete active space configuration interaction wavefunctions with floating occupation molecular orbitals
Edward G Hohenstein
Journal of the American Chemical Society
|
January 5, 2016
Mechanism for the Enhanced Excited-State Lewis Acidity of Methyl Viologen
Edward G Hohenstein
Journal of Chemical Theory and Computation
|
February 4, 2017
Improved Complete Active Space Configuration Interaction Energies with a Simple Correction from Density Functional Theory
Shiela Pijeau, Edward G Hohenstein
The Journal of Physical Chemistry. A
|
January 10, 2009
Effects of heteroatoms on aromatic pi-pi interactions: benzene-pyridine and pyridine dimer
Edward G Hohenstein, C David Sherrill
The Journal of Chemical Physics
|
November 14, 2021
GPU acceleration of rank-reduced coupled-cluster singles and doubles
Edward G Hohenstein, Todd J Martínez
The Journal of Chemical Physics
|
July 10, 2010
Density fitting of intramonomer correlation effects in symmetry-adapted perturbation theory
Edward G Hohenstein, C David Sherrill
The Journal of Chemical Physics
|
September 21, 2010
Efficient evaluation of triple excitations in symmetry-adapted perturbation theory via second-order Møller-Plesset perturbation theory natural orbitals
Edward G Hohenstein, C David Sherrill
The Journal of Physical Chemistry. A
|
June 1, 2018
Effect of Nonplanarity on Excited-State Proton Transfer and Internal Conversion in Salicylideneaniline
Shiela Pijeau, Donneille Foster, Edward G Hohenstein
The Journal of Physical Chemistry. A
|
August 9, 2017
Excited-State Dynamics of a Benzotriazole Photostabilizer: 2-(2'-Hydroxy-5'-methylphenyl)benzotriazole
Shiela Pijeau, Donneille Foster, Edward G Hohenstein
The Journal of Physical Chemistry. A
|
May 31, 2017
Excited-State Dynamics of 2-(2'-Hydroxyphenyl)benzothiazole: Ultrafast Proton Transfer and Internal Conversion
Shiela Pijeau, Donneille Foster, Edward G Hohenstein
Page
of 7
Search research articles
Search
Showing results (1-10 of 68) with videos related to
Sort By:
Page
of 7
The Journal of Chemical Physics
|
November 10, 2016
Analytic formulation of derivative coupling vectors for complete active space configuration interaction wavefunctions with floating occupation molecular orbitals
Edward G Hohenstein
Journal of the American Chemical Society
|
January 5, 2016
Mechanism for the Enhanced Excited-State Lewis Acidity of Methyl Viologen
Edward G Hohenstein
Journal of Chemical Theory and Computation
|
February 4, 2017
Improved Complete Active Space Configuration Interaction Energies with a Simple Correction from Density Functional Theory
Shiela Pijeau, Edward G Hohenstein
The Journal of Physical Chemistry. A
|
January 10, 2009
Effects of heteroatoms on aromatic pi-pi interactions: benzene-pyridine and pyridine dimer
Edward G Hohenstein, C David Sherrill
The Journal of Chemical Physics
|
November 14, 2021
GPU acceleration of rank-reduced coupled-cluster singles and doubles
Edward G Hohenstein, Todd J Martínez
The Journal of Chemical Physics
|
July 10, 2010
Density fitting of intramonomer correlation effects in symmetry-adapted perturbation theory
Edward G Hohenstein, C David Sherrill
The Journal of Chemical Physics
|
September 21, 2010
Efficient evaluation of triple excitations in symmetry-adapted perturbation theory via second-order Møller-Plesset perturbation theory natural orbitals
Edward G Hohenstein, C David Sherrill
The Journal of Physical Chemistry. A
|
June 1, 2018
Effect of Nonplanarity on Excited-State Proton Transfer and Internal Conversion in Salicylideneaniline
Shiela Pijeau, Donneille Foster, Edward G Hohenstein
The Journal of Physical Chemistry. A
|
August 9, 2017
Excited-State Dynamics of a Benzotriazole Photostabilizer: 2-(2'-Hydroxy-5'-methylphenyl)benzotriazole
Shiela Pijeau, Donneille Foster, Edward G Hohenstein
The Journal of Physical Chemistry. A
|
May 31, 2017
Excited-State Dynamics of 2-(2'-Hydroxyphenyl)benzothiazole: Ultrafast Proton Transfer and Internal Conversion
Shiela Pijeau, Donneille Foster, Edward G Hohenstein
Page
of 7