Can the coupled cluster method improve many-body perturbation theory reaction energies significantly? the H2CO → H2 + CO reaction

Chemical Physics Letters ◽

10.1016/0009-2614(87)85169-2 ◽

1987 ◽

Vol 135 (4-5) ◽

pp. 346-351 ◽

Author(s):

Miroslav Urban ◽

Vladimir Kellö ◽

Ivan Černušák ◽

Jozef Noga ◽

Geerd H.F. Diercksen

Keyword(s):

Perturbation Theory ◽

Cluster Method ◽

Coupled Cluster ◽

Coupled Cluster Method ◽

Many Body ◽

Many Body Perturbation Theory ◽

Reaction Energies

Download Full-text

Comparison of complete model space quasidegenerate many‐body perturbation theory for LiH with multireference coupled cluster method

The Journal of Chemical Physics ◽

10.1063/1.456921 ◽

1989 ◽

Vol 91 (5) ◽

pp. 3002-3011 ◽

Author(s):

Xiao‐Chuan Wang ◽

Karl F. Freed

Keyword(s):

Perturbation Theory ◽

Model Space ◽

Cluster Method ◽

Coupled Cluster ◽

Coupled Cluster Method ◽

Many Body ◽

Complete Model ◽

Many Body Perturbation Theory

Download Full-text

A study of Be2with many‐body perturbation theory and a coupled‐cluster method including triple excitations

The Journal of Chemical Physics ◽

10.1063/1.447214 ◽

1984 ◽

Vol 80 (9) ◽

pp. 4371-4377 ◽

Author(s):

Yoon S. Lee ◽

Rodney J. Bartlett

Keyword(s):

Perturbation Theory ◽

Cluster Method ◽

Coupled Cluster ◽

Coupled Cluster Method ◽

Many Body ◽

Many Body Perturbation Theory

Download Full-text

Extended Coupled Cluster Method: Quantum Many-Body Theory Made Classical

Condensed Matter Theories ◽

10.1007/978-1-4613-0917-8_41 ◽

1987 ◽

pp. 357-372 ◽

Author(s):

J. Arponen ◽

R. F. Bishop ◽

E. Pajanne

Keyword(s):

Cluster Method ◽

Coupled Cluster ◽

Coupled Cluster Method ◽

Many Body ◽

Many Body Theory ◽

Body Theory ◽

Extended Coupled Cluster Method

Download Full-text

Table 41. H2 16O (H16OH): Potential Energy Surface (PES) for various Coupled Cluster/Many-Body Perturbation Theory (CC/MBPT) models

Non-linear Triatomic Molecules ◽

10.1007/978-3-540-47383-1_43 ◽

2012 ◽

pp. 135-136

Author(s):

G. Guelachvili ◽

N. Picqué

Keyword(s):

Perturbation Theory ◽

Potential Energy ◽

Potential Energy Surface ◽

Energy Surface ◽

Coupled Cluster ◽

Many Body ◽

Many Body Perturbation Theory

Download Full-text

New Developments in Many Body Perturbation Theory and Coupled Cluster Theory

Conceptual Perspectives in Quantum Chemistry ◽

10.1007/978-94-011-5572-4_8 ◽

1997 ◽

pp. 239-318 ◽

Author(s):

Dieter Cremer ◽

Zhi He

Keyword(s):

Perturbation Theory ◽

Coupled Cluster ◽

Many Body ◽

Coupled Cluster Theory ◽

Cluster Theory ◽

New Developments ◽

Many Body Perturbation Theory

Download Full-text

Many-Body Perturbation Theory and Coupled Cluster Theory for Electron Correlation in Molecules

Annual Review of Physical Chemistry ◽

10.1146/annurev.pc.32.100181.002043 ◽

1981 ◽

Vol 32 (1) ◽

pp. 359-401 ◽

Cited By ~ 1617

Author(s):

R J Bartlett

Keyword(s):

Perturbation Theory ◽

Electron Correlation ◽

Coupled Cluster ◽

Many Body ◽

Coupled Cluster Theory ◽

Cluster Theory ◽

Many Body Perturbation Theory

Download Full-text

Many‐body methods for excited state potential energy surfaces. II. Analytic second derivatives for excited state energies in the equation‐of‐motion coupled cluster method

The Journal of Chemical Physics ◽

10.1063/1.470083 ◽

1995 ◽

Vol 103 (20) ◽

pp. 8931-8943 ◽

Author(s):

John F. Stanton ◽

Jürgen Gauss

Keyword(s):

Excited State ◽

Potential Energy Surfaces ◽

Equation Of Motion ◽

Cluster Method ◽

Coupled Cluster ◽

Coupled Cluster Method ◽

Many Body ◽

Second Derivatives ◽

State Potential ◽

Energy Surfaces

Download Full-text

Time-dependent optimized coupled-cluster method for multielectron dynamics. III. A second-order many-body perturbation approximation

The Journal of Chemical Physics ◽

10.1063/5.0008789 ◽

2020 ◽

Vol 153 (3) ◽

pp. 034110

Author(s):

Himadri Pathak ◽

Takeshi Sato ◽

Kenichi L. Ishikawa

Keyword(s):

Second Order ◽

Time Dependent ◽

Cluster Method ◽

Coupled Cluster ◽

Coupled Cluster Method ◽

Many Body ◽

Perturbation Approximation

Download Full-text

Erratum: “Stochastic multi-reference perturbation theory with application to the linearized coupled cluster method” [J. Chem. Phys. 146, 044107 (2017)]

The Journal of Chemical Physics ◽

10.1063/1.4986407 ◽

2017 ◽

Vol 146 (23) ◽

pp. 239901 ◽

Author(s):

Guillaume Jeanmairet ◽

Sandeep Sharma ◽

Ali Alavi

Keyword(s):

Perturbation Theory ◽

Chem Phys ◽

Cluster Method ◽

Coupled Cluster ◽

Coupled Cluster Method

Download Full-text

Multireference coupled cluster method based on the Brillouin-Wigner perturbation theory

Theory and Applications of Computational Chemistry ◽

10.1016/b978-044451719-7/50061-5 ◽

2005 ◽

pp. 465-481 ◽

Author(s):

Petr Čársky ◽

Jiří Pittner ◽

Ivan Hubač

Keyword(s):

Perturbation Theory ◽

Cluster Method ◽

Coupled Cluster ◽

Coupled Cluster Method

Download Full-text