Local space approximation for configuration interaction and coupled cluster wave functions

Bernard Kirtman; Clifford E. Dykstra

doi:10.1063/1.451036

Local space approximation for configuration interaction and coupled cluster wave functions

The Journal of Chemical Physics ◽

10.1063/1.451036 ◽

1986 ◽

Vol 85 (5) ◽

pp. 2791-2796 ◽

Cited By ~ 49

Author(s):

Bernard Kirtman ◽

Clifford E. Dykstra

Keyword(s):

Configuration Interaction ◽

Wave Functions ◽

Coupled Cluster ◽

Local Space

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On the orbital dependence of compact, weight-selected configuration interaction and coupled-cluster wave functions

Molecular Physics ◽

10.1080/00268970500302436 ◽

2005 ◽

Vol 103 (24) ◽

pp. 3315-3320 ◽

Cited By ~ 6

Author(s):

Micah L. Abrams ◽

C. David Sherrill

Keyword(s):

Configuration Interaction ◽

Wave Functions ◽

Coupled Cluster

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Important configurations in configuration interaction and coupled-cluster wave functions

Chemical Physics Letters ◽

10.1016/j.cplett.2005.06.107 ◽

2005 ◽

Vol 412 (1-3) ◽

pp. 121-124 ◽

Cited By ~ 30

Author(s):

Micah L. Abrams ◽

C. David Sherrill

Keyword(s):

Configuration Interaction ◽

Wave Functions ◽

Coupled Cluster

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Method of Moments of Coupled-Cluster Equations: Externally Corrected Approaches Employing Configuration Interaction Wave Functions

International Journal of Molecular Sciences ◽

10.3390/i3050475 ◽

2002 ◽

Vol 3 (5) ◽

pp. 475-497 ◽

Cited By ~ 25

Author(s):

Piotr Piecuch ◽

Karol Kowalski ◽

Ian Pimienta

Keyword(s):

Method Of Moments ◽

Configuration Interaction ◽

Wave Functions ◽

Coupled Cluster

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Spin-orbit-resolved static polarizabilities of group-13 atoms: Four-component relativistic configuration interaction and coupled cluster calculations

Physical Review A ◽

10.1103/physreva.72.052506 ◽

2005 ◽

Vol 72 (5) ◽

Cited By ~ 27

Author(s):

Timo Fleig

Keyword(s):

Configuration Interaction ◽

Coupled Cluster ◽

Spin Orbit ◽

Group 13 ◽

Cluster Calculations ◽

Relativistic Configuration ◽

Relativistic Configuration Interaction ◽

Coupled Cluster Calculations

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Spin–orbit coupling and electron correlation in relativistic configuration interaction and coupled-cluster methods

Chemical Physics ◽

10.1016/j.chemphys.2011.05.002 ◽

2012 ◽

Vol 395 ◽

pp. 115-121 ◽

Cited By ~ 24

Author(s):

Inkoo Kim ◽

Young Choon Park ◽

Hyungjun Kim ◽

Yoon Sup Lee

Keyword(s):

Configuration Interaction ◽

Electron Correlation ◽

Orbit Coupling ◽

Coupled Cluster ◽

Spin Orbit Coupling ◽

Spin Orbit ◽

Coupled Cluster Methods ◽

Relativistic Configuration ◽

Relativistic Configuration Interaction ◽

Cluster Methods

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Self‐consistent intermediate Hamiltonians: A coupled cluster type formulation of the singles and doubles configuration interaction matrix dressing

The Journal of Chemical Physics ◽

10.1063/1.469680 ◽

1995 ◽

Vol 103 (7) ◽

pp. 2576-2588 ◽

Cited By ~ 42

Author(s):

I. Nebot‐Gil ◽

J. Sánchez‐Marín ◽

J. P. Malrieu ◽

J. L. Heully ◽

D. Maynau

Keyword(s):

Configuration Interaction ◽

Interaction Matrix ◽

Coupled Cluster ◽

Self Consistent ◽

Cluster Type ◽

Intermediate Hamiltonians

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Feshbach–Fano approach for calculation of Auger decay rates using equation-of-motion coupled-cluster wave functions. II. Numerical examples and benchmarks

The Journal of Chemical Physics ◽

10.1063/5.0036977 ◽

2021 ◽

Vol 154 (8) ◽

pp. 084125 ◽

Cited By ~ 1

Author(s):

Wojciech Skomorowski ◽

Anna I. Krylov

Keyword(s):

Equation Of Motion ◽

Decay Rates ◽

Wave Functions ◽

Coupled Cluster ◽

Auger Decay ◽

Numerical Examples

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Correlations in Nuclei: Configuration Interaction, Coupled-Cluster and Beyond

10.1063/1.2870367 ◽

2008 ◽

Author(s):

Mihai Horoi ◽

Livius Trache ◽

Sabin Stoica

Keyword(s):

Configuration Interaction ◽

Coupled Cluster

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The group 12 metal chalcogenides: an accurate multireference configuration interaction and coupled cluster study

Molecular Physics ◽

10.1080/00268970701241664 ◽

2007 ◽

Vol 105 (9) ◽

pp. 1139-1155 ◽

Cited By ~ 39

Author(s):

K. A. Peterson ◽

B. C. Shepler ◽

J. M. Singleton

Keyword(s):

Configuration Interaction ◽

Coupled Cluster ◽

Metal Chalcogenides ◽

Group 12

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Perturbatively Selected Configuration-Interaction Wave Functions for Efficient Geometry Optimization in Quantum Monte Carlo

Journal of Chemical Theory and Computation ◽

10.1021/acs.jctc.8b00393 ◽

2018 ◽

Vol 14 (8) ◽

pp. 4176-4182 ◽

Cited By ~ 23

Author(s):

Monika Dash ◽

Saverio Moroni ◽

Anthony Scemama ◽

Claudia Filippi

Keyword(s):

Monte Carlo ◽

Configuration Interaction ◽

Quantum Monte Carlo ◽

Geometry Optimization ◽

Wave Functions

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