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The Journal of Chemical Physics
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April 2, 2009
Quadratic canonical transformation theory and higher order density matrices
Eric Neuscamman, Takeshi Yanai, Garnet Kin-Lic Chan
Journal of Chemical Theory and Computation
|
August 21, 2020
N<sup>5</sup>-Scaling Excited-State-Specific Perturbation Theory
Rachel Clune, Jacqueline A R Shea, Eric Neuscamman
Journal of Chemical Theory and Computation
|
August 9, 2019
Tracking Excited States in Wave Function Optimization Using Density Matrices and Variational Principles
Lan Nguyen Tran, Jacqueline A R Shea, Eric Neuscamman
Journal of Chemical Theory and Computation
|
January 9, 2019
Clean and Convenient Tessellations for Number Counting Jastrow Factors
Beatrice W. Van Der Goetz, Leon Otis, Eric Neuscamman
The Journal of Chemical Physics
|
November 4, 2017
Excitation variance matching with limited configuration interaction expansions in variational Monte Carlo
Paul J Robinson, Sergio D Pineda Flores, Eric Neuscamman
The Journal of Chemical Physics
|
May 27, 2009
A study of cumulant approximations to n-electron valence multireference perturbation theory
Dominika Zgid, Debashree Ghosh, Eric Neuscamman, et al.
Physical Chemistry Chemical Physics : PCCP
|
May 12, 2012
Extended implementation of canonical transformation theory: parallelization and a new level-shifted condition
Takeshi Yanai, Yuki Kurashige, Eric Neuscamman, et al.
The Journal of Chemical Physics
|
January 26, 2010
Multireference quantum chemistry through a joint density matrix renormalization group and canonical transformation theory
Takeshi Yanai, Yuki Kurashige, Eric Neuscamman, et al.
Journal of the American Chemical Society
|
January 18, 2024
Spin Coupling Effect on Geometry-Dependent X-Ray Absorption of Diradicals
Scott M Garner, Eric A Haugen, Stephen R Leone, et al.
The Journal of Chemical Physics
|
July 9, 2025
Vibrations and the passage through a diabolic point in the anthracene dimer
Alexander K Lemmens, Nureshan Dias, Harrison G Tuckman, et al.
Page
of 6
Search research articles
Search
Showing results (41-50 of 54) with videos related to
Sort By:
Page
of 6
The Journal of Chemical Physics
|
April 2, 2009
Quadratic canonical transformation theory and higher order density matrices
Eric Neuscamman, Takeshi Yanai, Garnet Kin-Lic Chan
Journal of Chemical Theory and Computation
|
August 21, 2020
N<sup>5</sup>-Scaling Excited-State-Specific Perturbation Theory
Rachel Clune, Jacqueline A R Shea, Eric Neuscamman
Journal of Chemical Theory and Computation
|
August 9, 2019
Tracking Excited States in Wave Function Optimization Using Density Matrices and Variational Principles
Lan Nguyen Tran, Jacqueline A R Shea, Eric Neuscamman
Journal of Chemical Theory and Computation
|
January 9, 2019
Clean and Convenient Tessellations for Number Counting Jastrow Factors
Beatrice W. Van Der Goetz, Leon Otis, Eric Neuscamman
The Journal of Chemical Physics
|
November 4, 2017
Excitation variance matching with limited configuration interaction expansions in variational Monte Carlo
Paul J Robinson, Sergio D Pineda Flores, Eric Neuscamman
The Journal of Chemical Physics
|
May 27, 2009
A study of cumulant approximations to n-electron valence multireference perturbation theory
Dominika Zgid, Debashree Ghosh, Eric Neuscamman, et al.
Physical Chemistry Chemical Physics : PCCP
|
May 12, 2012
Extended implementation of canonical transformation theory: parallelization and a new level-shifted condition
Takeshi Yanai, Yuki Kurashige, Eric Neuscamman, et al.
The Journal of Chemical Physics
|
January 26, 2010
Multireference quantum chemistry through a joint density matrix renormalization group and canonical transformation theory
Takeshi Yanai, Yuki Kurashige, Eric Neuscamman, et al.
Journal of the American Chemical Society
|
January 18, 2024
Spin Coupling Effect on Geometry-Dependent X-Ray Absorption of Diradicals
Scott M Garner, Eric A Haugen, Stephen R Leone, et al.
The Journal of Chemical Physics
|
July 9, 2025
Vibrations and the passage through a diabolic point in the anthracene dimer
Alexander K Lemmens, Nureshan Dias, Harrison G Tuckman, et al.
Page
of 6