Mo/ller–Plesset perturbation theory calculation of alkaline earth–rare gas complexes: Ground states of Mg–He and Mg–Ar

David J. Funk; W. H. Breckenridge; Jack Simons; Grzegorz Chal/asiński

doi:10.1063/1.457630

Mo/ller–Plesset perturbation theory calculation of alkaline earth–rare gas complexes: Ground states of Mg–He and Mg–Ar

The Journal of Chemical Physics ◽

10.1063/1.457630 ◽

1989 ◽

Vol 91 (2) ◽

pp. 1114-1120 ◽

Cited By ~ 19

Author(s):

David J. Funk ◽

W. H. Breckenridge ◽

Jack Simons ◽

Grzegorz Chal/asiński

Keyword(s):

Perturbation Theory ◽

Alkaline Earth ◽

Ground States ◽

Rare Gas ◽

Theory Calculation ◽

Plesset Perturbation Theory

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Static hyperpolarisabilities and polarisabilities for Be: a fourth-order Moller-Plesset perturbation theory calculation

Journal of Physics B Atomic Molecular and Optical Physics ◽

10.1088/0953-4075/21/23/004 ◽

1988 ◽

Vol 21 (23) ◽

pp. 3819-3831 ◽

Cited By ~ 42

Author(s):

G Maroulis ◽

A J Thakkar

Keyword(s):

Perturbation Theory ◽

Fourth Order ◽

Moller Plesset ◽

Theory Calculation ◽

Plesset Perturbation Theory

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Basis set effects on the intermolecular interaction energies of methane dimers obtained by the Moeller-Plesset perturbation theory calculation

The Journal of Physical Chemistry ◽

10.1021/j100159a032 ◽

1991 ◽

Vol 95 (6) ◽

pp. 2272-2278 ◽

Cited By ~ 42

Author(s):

Seiji Tsuzuki ◽

Kazutoshi Tanabe

Keyword(s):

Perturbation Theory ◽

Intermolecular Interaction ◽

Basis Set ◽

Interaction Energies ◽

Theory Calculation ◽

Plesset Perturbation Theory

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Relativistic Hartree–Fock by means of stationary direct perturbation theory. II. Ground states of rare gas atoms

The Journal of Chemical Physics ◽

10.1063/1.468702 ◽

1995 ◽

Vol 102 (4) ◽

pp. 1752-1757 ◽

Cited By ~ 45

Author(s):

Edgar Ottschofski ◽

Werner Kutzelnigg

Keyword(s):

Perturbation Theory ◽

Ground States ◽

Rare Gas ◽

Hartree Fock ◽

Direct Perturbation ◽

Rare Gas Atoms

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Mo/ller–Plesset perturbation theory for van der Waals complexes bound by electron correlation effects: Ground states of the Ar and Mg dimers

The Journal of Chemical Physics ◽

10.1063/1.453002 ◽

1987 ◽

Vol 87 (6) ◽

pp. 3569-3579 ◽

Cited By ~ 66

Author(s):

Grzegorz Chal/asiński ◽

David J. Funk ◽

Jack Simons ◽

W. H. Breckenridge

Keyword(s):

Perturbation Theory ◽

Electron Correlation ◽

Van Der Waals ◽

Ground States ◽

Van Der Waals Complexes ◽

Correlation Effects ◽

Electron Correlation Effects ◽

Plesset Perturbation Theory

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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

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Tensor hypercontraction density fitting. I. Quartic scaling second- and third-order Møller-Plesset perturbation theory

The Journal of Chemical Physics ◽

10.1063/1.4732310 ◽

2012 ◽

Vol 137 (4) ◽

pp. 044103 ◽

Cited By ~ 142

Author(s):

Edward G. Hohenstein ◽

Robert M. Parrish ◽

Todd J. Martínez

Keyword(s):

Perturbation Theory ◽

Third Order ◽

Density Fitting ◽

Moller Plesset ◽

Plesset Perturbation Theory

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Second order Møller-Plesset perturbation theory based upon the fragment molecular orbital method

The Journal of Chemical Physics ◽

10.1063/1.1769362 ◽

2004 ◽

Vol 121 (6) ◽

pp. 2483 ◽

Cited By ~ 215

Author(s):

Dmitri G. Fedorov ◽

Kazuo Kitaura

Keyword(s):

Perturbation Theory ◽

Molecular Orbital ◽

Second Order ◽

Orbital Method ◽

Molecular Orbital Method ◽

Fragment Molecular Orbital ◽

Moller Plesset ◽

Plesset Perturbation Theory

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Binding Energy Curves from Nonempirical Density Functionals II. van der Waals Bonds in Rare-Gas and Alkaline-Earth Diatomics

The Journal of Physical Chemistry A ◽

10.1021/jp053905d ◽

2005 ◽

Vol 109 (48) ◽

pp. 11015-11021 ◽

Cited By ~ 70

Author(s):

Adrienn Ruzsinszky ◽

John P. Perdew ◽

Gábor I. Csonka

Keyword(s):

Binding Energy ◽

Alkaline Earth ◽

Van Der Waals ◽

Rare Gas ◽

Density Functionals

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NMR shielding tensors for density fitted local second-order Møller-Plesset perturbation theory using gauge including atomic orbitals

The Journal of Chemical Physics ◽

10.1063/1.4744102 ◽

2012 ◽

Vol 137 (8) ◽

pp. 084107 ◽

Cited By ~ 25

Author(s):

Stefan Loibl ◽

Martin Schütz

Keyword(s):

Perturbation Theory ◽

Second Order ◽

Atomic Orbitals ◽

Shielding Tensors ◽

Moller Plesset ◽

Plesset Perturbation Theory

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The molecular gradient using the divide-expand-consolidate resolution of the identity second-order Møller-Plesset perturbation theory: The DEC-RI-MP2 gradient

The Journal of Chemical Physics ◽

10.1063/1.4956454 ◽

2016 ◽

Vol 145 (2) ◽

pp. 024106 ◽

Cited By ~ 15

Author(s):

Dmytro Bykov ◽

Kasper Kristensen ◽

Thomas Kjærgaard

Keyword(s):

Perturbation Theory ◽

Second Order ◽

Resolution Of The Identity ◽

Moller Plesset ◽

Plesset Perturbation Theory

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