Correction to “Variational Relativistic Two-Component Complete-Active-Space Self-Consistent Field Method”

Andrew J. Jenkins; Hongbin Liu; Joseph M. Kasper; Michael J. Frisch; Xiaosong Li

doi:10.1021/acs.jctc.0c00317

Correction to “Variational Relativistic Two-Component Complete-Active-Space Self-Consistent Field Method”

Journal of Chemical Theory and Computation ◽

10.1021/acs.jctc.0c00317 ◽

2020 ◽

Vol 16 (5) ◽

pp. 3445-3445

Author(s):

Andrew J. Jenkins ◽

Hongbin Liu ◽

Joseph M. Kasper ◽

Michael J. Frisch ◽

Xiaosong Li

Keyword(s):

Field Method ◽

Complete Active Space ◽

Active Space ◽

Consistent Field ◽

Two Component ◽

Self Consistent ◽

Self Consistent Field

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The Kramers’ restricted complete active space self-consistent-field method for two-component molecular spinors and relativistic effective core potentials including spin–orbit interactions

The Journal of Chemical Physics ◽

10.1063/1.1626542 ◽

2003 ◽

Vol 119 (23) ◽

pp. 12169-12178 ◽

Cited By ~ 24

Author(s):

Yong Seok Kim ◽

Yoon Sup Lee

Keyword(s):

Field Method ◽

Spin Orbit ◽

Complete Active Space ◽

Active Space ◽

Consistent Field ◽

Two Component ◽

Self Consistent ◽

Self Consistent Field ◽

Spin Orbit Interactions ◽

Effective Core Potentials

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Variational Relativistic Two-Component Complete-Active-Space Self-Consistent Field Method

Journal of Chemical Theory and Computation ◽

10.1021/acs.jctc.9b00011 ◽

2019 ◽

Vol 15 (5) ◽

pp. 2974-2982 ◽

Cited By ~ 9

Author(s):

Andrew J. Jenkins ◽

Hongbin Liu ◽

Joseph M. Kasper ◽

Michael J. Frisch ◽

Xiaosong Li

Keyword(s):

Field Method ◽

Complete Active Space ◽

Active Space ◽

Consistent Field ◽

Two Component ◽

Self Consistent ◽

Self Consistent Field

Download Full-text

Two-component Kramers restricted complete active space self-consistent field method with relativistic effective core potential revisited: Theory, implementation, and applications to spin-orbit splitting of lower p-block atoms

The Journal of Chemical Physics ◽

10.1063/1.4822426 ◽

2013 ◽

Vol 139 (13) ◽

pp. 134115 ◽

Cited By ~ 9

Author(s):

Inkoo Kim ◽

Yoon Sup Lee

Keyword(s):

Field Method ◽

Spin Orbit ◽

Effective Core Potential ◽

Orbit Splitting ◽

Complete Active Space ◽

Consistent Field ◽

Spin Orbit Splitting ◽

Two Component ◽

Self Consistent ◽

Self Consistent Field

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Time-dependent complete active-space self-consistent field method for multielectron dynamics in intense laser fields

2013 Conference on Lasers and Electro-Optics Pacific Rim (CLEOPR) ◽

10.1109/cleopr.2013.6600023 ◽

2013 ◽

Author(s):

A. Takeshi Sato ◽

Kenichi L. Ishikawa

Keyword(s):

Field Method ◽

Time Dependent ◽

Intense Laser ◽

Intense Laser Fields ◽

Laser Fields ◽

Complete Active Space ◽

Active Space ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field

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Molecular g-tensors from analytical response theory and quasi-degenerate perturbation theory in the framework of complete active space self-consistent field method

Molecular Physics ◽

10.1080/00268976.2015.1012128 ◽

2015 ◽

Vol 113 (13-14) ◽

pp. 1750-1767 ◽

Cited By ~ 3

Author(s):

Tran Nguyen Lan ◽

Jakub Chalupský ◽

Takeshi Yanai

Keyword(s):

Perturbation Theory ◽

Field Method ◽

Response Theory ◽

Complete Active Space ◽

Active Space ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field ◽

Analytical Response ◽

Degenerate Perturbation Theory

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Publisher's Note: “Two-component Kramers restricted complete active space self-consistent field method with relativistic effective core potential revisited: Theory, implementation, and applications to spin-orbit splitting of lower p-block atoms” [J. Chem. Phys. 139, 134115 (2013)]

The Journal of Chemical Physics ◽

10.1063/1.4826564 ◽

2013 ◽

Vol 139 (16) ◽

pp. 169901

Author(s):

Inkoo Kim ◽

Yoon Sup Lee

Keyword(s):

Field Method ◽

Chem Phys ◽

Spin Orbit ◽

Orbit Splitting ◽

Complete Active Space ◽

Consistent Field ◽

Spin Orbit Splitting ◽

Two Component ◽

Self Consistent ◽

Self Consistent Field

Download Full-text

Time-dependent complete-active-space self-consistent-field method for atoms: Application to high-order harmonic generation

Physical Review A ◽

10.1103/physreva.94.023405 ◽

2016 ◽

Vol 94 (2) ◽

Cited By ~ 46

Author(s):

Takeshi Sato ◽

Kenichi L. Ishikawa ◽

Iva Březinová ◽

Fabian Lackner ◽

Stefan Nagele ◽

...

Keyword(s):

Harmonic Generation ◽

Field Method ◽

Time Dependent ◽

High Order Harmonic Generation ◽

Complete Active Space ◽

Active Space ◽

High Order Harmonic ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field

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Time-dependent complete-active-space self-consistent-field method for multielectron dynamics in intense laser fields

Physical Review A ◽

10.1103/physreva.88.023402 ◽

2013 ◽

Vol 88 (2) ◽

Cited By ~ 102

Author(s):

Takeshi Sato ◽

Kenichi L. Ishikawa

Keyword(s):

Field Method ◽

Time Dependent ◽

Intense Laser ◽

Intense Laser Fields ◽

Laser Fields ◽

Complete Active Space ◽

Active Space ◽

Consistent Field ◽

Self Consistent ◽

Self Consistent Field

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Analytical gradients of the state-average complete active space self-consistent field method with density fitting

The Journal of Chemical Physics ◽

10.1063/1.4927228 ◽

2015 ◽

Vol 143 (4) ◽

pp. 044110 ◽

Cited By ~ 21

Author(s):

Mickaël G. Delcey ◽

Thomas Bondo Pedersen ◽

Francesco Aquilante ◽

Roland Lindh

Keyword(s):

Field Method ◽

The State ◽

Complete Active Space ◽

Active Space ◽

Consistent Field ◽

Density Fitting ◽

Self Consistent ◽

Self Consistent Field ◽

Analytical Gradients ◽

State Average

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Erratum: The Kramers’ restricted complete active space self-consistent-field method for two-component molecular spinors and relativistic effective core potentials including spin–orbit interactions [J. Chem. Phys. 119, 12169 (2003)]

The Journal of Chemical Physics ◽

10.1063/1.1667463 ◽

2004 ◽

Vol 120 (14) ◽

pp. 6797-6797

Author(s):

Yong Seok Kim ◽

Yoon Sup Lee

Keyword(s):

Field Method ◽

Chem Phys ◽

Spin Orbit ◽

Complete Active Space ◽

Consistent Field ◽

Two Component ◽

Self Consistent ◽

Self Consistent Field ◽

Spin Orbit Interactions ◽

Effective Core Potentials

Download Full-text