Development of an efficient linear response approach to the Hilbert space multi-reference coupled-cluster theory

K. R. Shamasundar; Sourav Pal

doi:10.1063/1.1336565

Development of an efficient linear response approach to the Hilbert space multi-reference coupled-cluster theory

The Journal of Chemical Physics ◽

10.1063/1.1336565 ◽

2001 ◽

Vol 114 (5) ◽

pp. 1981-1988 ◽

Cited By ~ 28

Author(s):

K. R. Shamasundar ◽

Sourav Pal

Keyword(s):

Hilbert Space ◽

Linear Response ◽

Coupled Cluster ◽

Coupled Cluster Theory ◽

Cluster Theory

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Erratum: “Development of an efficient linear response approach to the Hilbert space multireference coupled-cluster theory” [J. Chem. Phys. 114, 1981 (2001)]

The Journal of Chemical Physics ◽

10.1063/1.1383588 ◽

2001 ◽

Vol 115 (4) ◽

pp. 1979-1979 ◽

Cited By ~ 17

Author(s):

K. R. Shamasundar ◽

Sourav Pal

Keyword(s):

Hilbert Space ◽

Linear Response ◽

Chem Phys ◽

Coupled Cluster ◽

Coupled Cluster Theory ◽

Cluster Theory

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Linear response coupled cluster theory with the polarizable continuum model within the singles approximation for the solvent response

The Journal of Chemical Physics ◽

10.1063/1.5021781 ◽

2018 ◽

Vol 148 (13) ◽

pp. 134113 ◽

Cited By ~ 6

Author(s):

Marco Caricato

Keyword(s):

Linear Response ◽

Continuum Model ◽

Polarizable Continuum Model ◽

Coupled Cluster ◽

Coupled Cluster Theory ◽

Cluster Theory ◽

Polarizable Continuum

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Applications of core-valence extensive multi-reference coupled cluster theory and core-extensive coupled cluster-based linear response theory

Journal of Molecular Structure THEOCHEM ◽

10.1016/j.theochem.2006.05.015 ◽

2006 ◽

Vol 768 (1-3) ◽

pp. 133-140 ◽

Cited By ~ 4

Author(s):

Malaya K. Nayak ◽

Rajat K. Chaudhuri ◽

Sudip Chattopadhyay ◽

Uttam Sinha Mahapatra

Keyword(s):

Linear Response ◽

Linear Response Theory ◽

Coupled Cluster ◽

Response Theory ◽

Coupled Cluster Theory ◽

Cluster Theory

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Hilbert Space Coupled Cluster Theory

Many-Body Methods for Atoms and Molecules ◽

10.1201/9781315373881-15 ◽

2017 ◽

pp. 205-218

Keyword(s):

Hilbert Space ◽

Coupled Cluster ◽

Coupled Cluster Theory ◽

Cluster Theory

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Higher Energy Derivatives in Hilbert Space Multi-Reference Coupled Cluster Theory : A Constrained Variational Approach

International Journal of Molecular Sciences ◽

10.3390/i3060710 ◽

2002 ◽

Vol 3 (6) ◽

pp. 710-732 ◽

Cited By ~ 13

Author(s):

K. Shamasundar ◽

Sourav Pal

Keyword(s):

Hilbert Space ◽

Variational Approach ◽

Coupled Cluster ◽

Coupled Cluster Theory ◽

Cluster Theory ◽

Energy Derivatives

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Application of Hilbert-space coupled-cluster theory to simple (H2)2model systems: Planar models

Physical Review A ◽

10.1103/physreva.47.2738 ◽

1993 ◽

Vol 47 (4) ◽

pp. 2738-2782 ◽

Cited By ~ 193

Author(s):

J. Paldus ◽

P. Piecuch ◽

L. Pylypow ◽

B. Jeziorski

Keyword(s):

Hilbert Space ◽

Coupled Cluster ◽

Coupled Cluster Theory ◽

Cluster Theory

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Application of Hilbert-space coupled-cluster theory to simple (H2)2model systems. II. Nonplanar models

Physical Review A ◽

10.1103/physreva.49.3479 ◽

1994 ◽

Vol 49 (5) ◽

pp. 3479-3514 ◽

Cited By ~ 105

Author(s):

Piotr Piecuch ◽

Josef Paldus

Keyword(s):

Hilbert Space ◽

Coupled Cluster ◽

Coupled Cluster Theory ◽

Cluster Theory

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A linear response, coupled-cluster theory for excitation energy

International Journal of Quantum Chemistry ◽

10.1002/qua.560260826 ◽

1984 ◽

Vol 26 (S18) ◽

pp. 255-265 ◽

Cited By ~ 517

Author(s):

Hideo Sekino ◽

Rodney J. Bartlett

Keyword(s):

Excitation Energy ◽

Linear Response ◽

Coupled Cluster ◽

Coupled Cluster Theory ◽

Cluster Theory

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Approximate account of connected quadruply excited clusters in multi-reference Hilbert space coupled-cluster theory. Application to planar H4 models

Chemical Physics Letters ◽

10.1016/0009-2614(93)89129-6 ◽

1993 ◽

Vol 210 (1-3) ◽

pp. 243-252 ◽

Cited By ~ 44

Author(s):

Piotr Piecuch ◽

Robert Toboła ◽

Josef Paldus

Keyword(s):

Hilbert Space ◽

Coupled Cluster ◽

Coupled Cluster Theory ◽

Cluster Theory ◽

Theory Application

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Implementation of a Parallel Linear-Response Coupled-Cluster-Theory Module in ACES III

Concepts of Mathematical Physics in Chemistry: A Tribute to Frank E. Harris - Part B - Advances in Quantum Chemistry ◽

10.1016/bs.aiq.2015.06.008 ◽

2016 ◽

pp. 29-60 ◽

Cited By ~ 1

Author(s):

Ajith Perera ◽

Jorge A. Morales

Keyword(s):

Linear Response ◽

Coupled Cluster ◽

Coupled Cluster Theory ◽

Cluster Theory

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