Correction of Configuration‐Interaction Wavefunctions by Perturbation Theory

William H. Adams

doi:10.1063/1.1728122

Correction of Configuration‐Interaction Wavefunctions by Perturbation Theory

The Journal of Chemical Physics ◽

10.1063/1.1728122 ◽

1966 ◽

Vol 45 (9) ◽

pp. 3422-3424 ◽

Cited By ~ 22

Author(s):

William H. Adams

Keyword(s):

Perturbation Theory ◽

Configuration Interaction

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Application of perturbation theory in large configuration interaction calculations

Chemical Physics Letters ◽

10.1016/0009-2614(76)80172-8 ◽

1976 ◽

Vol 37 (1) ◽

pp. 110-114 ◽

Cited By ~ 13

Author(s):

P.J. Fortune ◽

Bruce J. Rosenberg

Keyword(s):

Perturbation Theory ◽

Configuration Interaction ◽

Configuration Interaction Calculations

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Perspective on “Group theoretical approach to the configuration interaction and perturbation theory calculations for atomic and molecular systems”

Theoretical Chemistry Accounts ◽

10.1007/978-3-662-10421-7_47 ◽

2000 ◽

pp. 317-321

Author(s):

Michael A. Robb

Keyword(s):

Perturbation Theory ◽

Configuration Interaction ◽

Theoretical Approach ◽

Molecular Systems

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Calculations of neon nuclear-spin optical rotation, Verdet and hyperfine constants with configuration-interaction many-body perturbation theory

The European Physical Journal D ◽

10.1140/epjd/e2019-90431-7 ◽

2019 ◽

Vol 73 (7) ◽

Cited By ~ 1

Author(s):

Igor Savukov ◽

Dmytro Filin ◽

Yue Zhu ◽

Rafael Castro ◽

Christian Hilty

Keyword(s):

Perturbation Theory ◽

Configuration Interaction ◽

Nuclear Spin ◽

Optical Rotation ◽

Many Body ◽

Hyperfine Constants ◽

Many Body Perturbation Theory

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Second-order perturbation theory and configuration interaction theory applied to medium-sized molecules: cyclopropane, ethylenimine, ethylene oxide, fluoroethane, and acetaldehyde

Journal of the American Chemical Society ◽

10.1021/ja00213a010 ◽

1988 ◽

Vol 110 (5) ◽

pp. 1388-1393 ◽

Cited By ~ 22

Author(s):

Emmanuel D. Simandiras ◽

Roger D. Amos ◽

Nicholas C. Handy ◽

Timothy J. Lee ◽

Julia E. Rice ◽

...

Keyword(s):

Perturbation Theory ◽

Ethylene Oxide ◽

Configuration Interaction ◽

Second Order ◽

Order Perturbation ◽

Order Perturbation Theory ◽

Interaction Theory ◽

Second Order Perturbation Theory

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Mixed configuration-interaction and many-body perturbation-theory calculations of energies and oscillator strengths ofJ=1odd states of neon

Physical Review A ◽

10.1103/physreva.66.052501 ◽

2002 ◽

Vol 66 (5) ◽

Cited By ~ 22

Author(s):

I. M. Savukov ◽

W. R. Johnson ◽

H. G. Berry

Keyword(s):

Perturbation Theory ◽

Configuration Interaction ◽

Oscillator Strengths ◽

Many Body ◽

Many Body Perturbation Theory

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The CIPT2 method: Coupling of multi-reference configuration interaction and multi-reference perturbation theory. Application to the chromium dimer

Molecular Physics ◽

10.1080/00268970412331317788 ◽

2004 ◽

Vol 102 (21-22) ◽

pp. 2369-2379 ◽

Cited By ~ 66

Author(s):

P. Celani ◽

H. Stoll ◽

H.-J. Werner ◽

P.J. Knowles *

Keyword(s):

Perturbation Theory ◽

Configuration Interaction ◽

Reference Configuration ◽

Theory Application

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A detailed study of the configuration selected multireference configuration interaction method combined with perturbation theory to correct the wave function

The Journal of Chemical Physics ◽

10.1063/1.466616 ◽

1994 ◽

Vol 100 (2) ◽

pp. 1380-1386 ◽

Cited By ~ 36

Author(s):

B. Engels

Keyword(s):

Wave Function ◽

Perturbation Theory ◽

Configuration Interaction ◽

Interaction Method ◽

Configuration Interaction Method

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Group theoretical approach to the configuration interaction and perturbation theory calculations for atomic and molecular systems

The Journal of Chemical Physics ◽

10.1063/1.1681883 ◽

1974 ◽

Vol 61 (12) ◽

pp. 5321-5330 ◽

Cited By ~ 414

Author(s):

Josef Paldus

Keyword(s):

Perturbation Theory ◽

Configuration Interaction ◽

Theoretical Approach ◽

Molecular Systems

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Correlation energy in triplet states comparison of many-body perturbation theory and configuration interaction for CH2 and O2

Chemical Physics Letters ◽

10.1016/0009-2614(82)83452-0 ◽

1982 ◽

Vol 85 (1) ◽

pp. 17-20 ◽

Cited By ~ 10

Author(s):

Petr Čársky ◽

Michal Svrček ◽

Ivan Hubač ◽

Franklin B. Brown ◽

Isaiah Shavitt

Keyword(s):

Perturbation Theory ◽

Configuration Interaction ◽

Correlation Energy ◽

Triplet States ◽

Many Body ◽

Many Body Perturbation Theory

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Advantages and limitations of Kohn–Sham orbitals as single electron basis for multireference configuration interaction and multireference perturbation theory

The Journal of Chemical Physics ◽

10.1063/1.1624593 ◽

2003 ◽

Vol 119 (22) ◽

pp. 11591-11601 ◽

Cited By ~ 22

Author(s):

Thomas Hupp ◽

Bernd Engels ◽

Andreas Görling

Keyword(s):

Perturbation Theory ◽

Configuration Interaction ◽

Single Electron ◽

Multireference Perturbation Theory

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