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The Journal of Chemical Physics
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August 17, 2017
Explicitly correlated N-electron valence state perturbation theory (NEVPT2-F12)
Yang Guo, Kantharuban Sivalingam, Edward F Valeev, et al.
Physical Chemistry Chemical Physics : PCCP
|
June 7, 2008
Equations of explicitly-correlated coupled-cluster methods
Toru Shiozaki, Muneaki Kamiya, So Hirata, et al.
The Journal of Chemical Physics
|
February 18, 2014
Semi-exact concentric atomic density fitting: reduced cost and increased accuracy compared to standard density fitting
David S Hollman, Henry F Schaefer, Edward F Valeev
Journal of Chemical Theory and Computation
|
July 31, 2024
Revisiting Artifacts of Kohn-Sham Density Functionals for Biosimulation
Samuel A Slattery, Jaden C Yon, Edward F Valeev
The Journal of Chemical Physics
|
July 24, 2015
Sparse maps—A systematic infrastructure for reduced-scaling electronic structure methods. I. An efficient and simple linear scaling local MP2 method that uses an intermediate basis of pair natural orbitals
Peter Pinski, Christoph Riplinger, Edward F Valeev, et al.
The Journal of Chemical Physics
|
February 12, 2009
Higher-order explicitly correlated coupled-cluster methods
Toru Shiozaki, Muneaki Kamiya, So Hirata, et al.
The Journal of Chemical Physics
|
February 24, 2020
Direct determination of optimal pair-natural orbitals in a real-space representation: The second-order Moller-Plesset energy
Jakob S Kottmann, Florian A Bischoff, Edward F Valeev
The Journal of Physical Chemistry. A
|
October 31, 2024
"Best" Iterative Coupled-Cluster Triples Model? More Evidence for 3CC
Nakul K Teke, Ajay Melekamburath, Bimal Gaudel, et al.
The Journal of Chemical Physics
|
February 12, 2015
Communication: stochastic evaluation of explicitly correlated second-order many-body perturbation energy
Soohaeng Yoo Willow, Jinmei Zhang, Edward F Valeev, et al.
The Journal of Chemical Physics
|
October 2, 2017
Communication: Explicitly correlated formalism for second-order single-particle Green's function
Fabijan Pavošević, Chong Peng, J V Ortiz, et al.
Page
of 9
Search research articles
Search
Showing results (41-50 of 87) with videos related to
Sort By:
Page
of 9
The Journal of Chemical Physics
|
August 17, 2017
Explicitly correlated N-electron valence state perturbation theory (NEVPT2-F12)
Yang Guo, Kantharuban Sivalingam, Edward F Valeev, et al.
Physical Chemistry Chemical Physics : PCCP
|
June 7, 2008
Equations of explicitly-correlated coupled-cluster methods
Toru Shiozaki, Muneaki Kamiya, So Hirata, et al.
The Journal of Chemical Physics
|
February 18, 2014
Semi-exact concentric atomic density fitting: reduced cost and increased accuracy compared to standard density fitting
David S Hollman, Henry F Schaefer, Edward F Valeev
Journal of Chemical Theory and Computation
|
July 31, 2024
Revisiting Artifacts of Kohn-Sham Density Functionals for Biosimulation
Samuel A Slattery, Jaden C Yon, Edward F Valeev
The Journal of Chemical Physics
|
July 24, 2015
Sparse maps—A systematic infrastructure for reduced-scaling electronic structure methods. I. An efficient and simple linear scaling local MP2 method that uses an intermediate basis of pair natural orbitals
Peter Pinski, Christoph Riplinger, Edward F Valeev, et al.
The Journal of Chemical Physics
|
February 12, 2009
Higher-order explicitly correlated coupled-cluster methods
Toru Shiozaki, Muneaki Kamiya, So Hirata, et al.
The Journal of Chemical Physics
|
February 24, 2020
Direct determination of optimal pair-natural orbitals in a real-space representation: The second-order Moller-Plesset energy
Jakob S Kottmann, Florian A Bischoff, Edward F Valeev
The Journal of Physical Chemistry. A
|
October 31, 2024
"Best" Iterative Coupled-Cluster Triples Model? More Evidence for 3CC
Nakul K Teke, Ajay Melekamburath, Bimal Gaudel, et al.
The Journal of Chemical Physics
|
February 12, 2015
Communication: stochastic evaluation of explicitly correlated second-order many-body perturbation energy
Soohaeng Yoo Willow, Jinmei Zhang, Edward F Valeev, et al.
The Journal of Chemical Physics
|
October 2, 2017
Communication: Explicitly correlated formalism for second-order single-particle Green's function
Fabijan Pavošević, Chong Peng, J V Ortiz, et al.
Page
of 9