Second‐order correlation energy for H2O using explicitly correlated Gaussian geminals

Robert Bukowski; Bogumil/ Jeziorski; Stanisl/aw Rybak; Krzysztof Szalewicz

doi:10.1063/1.469155

Second‐order correlation energy for H2O using explicitly correlated Gaussian geminals

The Journal of Chemical Physics ◽

10.1063/1.469155 ◽

1995 ◽

Vol 102 (2) ◽

pp. 888-897 ◽

Cited By ~ 41

Author(s):

Robert Bukowski ◽

Bogumil/ Jeziorski ◽

Stanisl/aw Rybak ◽

Krzysztof Szalewicz

Keyword(s):

Correlation Energy ◽

Second Order ◽

Explicitly Correlated

Download Full-text

Communication: Explicitly-correlated second-order correction to the correlation energy in the random-phase approximation

The Journal of Chemical Physics ◽

10.1063/1.4804282 ◽

2013 ◽

Vol 138 (18) ◽

pp. 181104 ◽

Cited By ~ 7

Author(s):

Anna-Sophia Hehn ◽

Wim Klopper

Keyword(s):

Random Phase Approximation ◽

Correlation Energy ◽

Random Phase ◽

Second Order ◽

Order Correction ◽

Phase Approximation ◽

Explicitly Correlated

Download Full-text

A scaled explicitly correlated F12 correction to second-order Møller–Plesset perturbation theory

The Journal of Chemical Physics ◽

10.1063/5.0033411 ◽

2021 ◽

Vol 154 (4) ◽

pp. 044101

Author(s):

L. Urban ◽

T. H. Thompson ◽

C. Ochsenfeld

Keyword(s):

Perturbation Theory ◽

Second Order ◽

Explicitly Correlated ◽

Moller Plesset ◽

Plesset Perturbation Theory

Download Full-text

Spin-resolved second-order correlation energy of the two-dimensional uniform electron gas

Physical Review B ◽

10.1103/physrevb.70.073101 ◽

2004 ◽

Vol 70 (7) ◽

Cited By ~ 11

Author(s):

Michael Seidl

Keyword(s):

Correlation Energy ◽

Electron Gas ◽

Second Order ◽

Two Dimensional ◽

Uniform Electron Gas

Download Full-text

The extended explicitly-correlated second-order approximate coupled-cluster singles and doubles ansatz suitable for response theory

The Journal of Chemical Physics ◽

10.1063/1.5094434 ◽

2019 ◽

Vol 150 (18) ◽

pp. 184110 ◽

Cited By ~ 1

Author(s):

Sebastian Höfener ◽

Nils Schieschke ◽

Wim Klopper ◽

Andreas Köhn

Keyword(s):

Second Order ◽

Coupled Cluster ◽

Response Theory ◽

Explicitly Correlated

Download Full-text

Explicitly correlated renormalized second-order Green’s function for accurate ionization potentials of closed-shell molecules

The Journal of Chemical Physics ◽

10.1063/1.5090983 ◽

2019 ◽

Vol 150 (21) ◽

pp. 214103 ◽

Cited By ~ 2

Author(s):

Nakul K. Teke ◽

Fabijan Pavošević ◽

Chong Peng ◽

Edward F. Valeev

Keyword(s):

Green’S Function ◽

Green's Function ◽

Closed Shell ◽

Second Order ◽

Ionization Potentials ◽

Explicitly Correlated

Download Full-text

Local explicitly correlated second-order Møller–Plesset perturbation theory with pair natural orbitals

The Journal of Chemical Physics ◽

10.1063/1.3624370 ◽

2011 ◽

Vol 135 (7) ◽

pp. 074107 ◽

Cited By ~ 72

Author(s):

David P. Tew ◽

Benjamin Helmich ◽

Christof Hättig

Keyword(s):

Perturbation Theory ◽

Second Order ◽

Natural Orbitals ◽

Explicitly Correlated ◽

Moller Plesset ◽

Plesset Perturbation Theory

Download Full-text

Explicitly correlated second-order perturbation theory calculations on molecules containing heavy main-group elements

Theoretical Chemistry Accounts ◽

10.1007/s00214-008-0441-8 ◽

2008 ◽

Vol 121 (1-2) ◽

pp. 11-19 ◽

Cited By ~ 26

Author(s):

Florian A. Bischoff ◽

Sebastian Höfener ◽

Andreas Glöß ◽

Wim Klopper

Keyword(s):

Perturbation Theory ◽

Main Group ◽

Second Order ◽

Order Perturbation ◽

Order Perturbation Theory ◽

Main Group Elements ◽

Explicitly Correlated ◽

Second Order Perturbation Theory

Download Full-text

Explicitly correlated second-order Møller-Plesset perturbation theory employing pseudospectral numerical quadratures

The Journal of Chemical Physics ◽

10.1063/1.4719037 ◽

2012 ◽

Vol 136 (20) ◽

pp. 204110 ◽

Cited By ~ 2

Author(s):

Denis Bokhan ◽

Dmitrii N. Trubnikov

Keyword(s):

Perturbation Theory ◽

Second Order ◽

Explicitly Correlated ◽

Moller Plesset ◽

Plesset Perturbation Theory ◽

Numerical Quadratures

Download Full-text

Perturbation calculation of molecular correlation energy using Gaussian‐type geminals. Second‐order pair energies of LiH and BH

The Journal of Chemical Physics ◽

10.1063/1.437120 ◽

1978 ◽

Vol 69 (9) ◽

pp. 3992-4000 ◽

Cited By ~ 42

Author(s):

Ludwik Adamowicz ◽

Andrzej J. Sadlej

Keyword(s):

Correlation Energy ◽

Second Order ◽

Perturbation Calculation ◽

Gaussian Type ◽

Molecular Correlation

Download Full-text

Communication: Stochastic evaluation of explicitly correlated second-order many-body perturbation energy

The Journal of Chemical Physics ◽

10.1063/1.4862255 ◽

2014 ◽

Vol 140 (3) ◽

pp. 031101 ◽

Cited By ~ 12

Author(s):

Soohaeng Yoo Willow ◽

Jinmei Zhang ◽

Edward F. Valeev ◽

So Hirata

Keyword(s):

Second Order ◽

Many Body ◽

Explicitly Correlated ◽

Perturbation Energy

Download Full-text