A universal explicit electron correlation correction applied to Mukherjee’s multi-reference perturbation theory

Chemical Physics Letters ◽

10.1016/j.cplett.2012.02.020 ◽

2012 ◽

Vol 531 ◽

pp. 247-251 ◽

Author(s):

Robin Haunschild ◽

Shuneng Mao ◽

Debashis Mukherjee ◽

Wim Klopper

Keyword(s):

Perturbation Theory ◽

Electron Correlation ◽

Correlation Correction ◽

Explicit Electron

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Communication: Extension of a universal explicit electron correlation correction to general complete active spaces

The Journal of Chemical Physics ◽

10.1063/1.4810748 ◽

2013 ◽

Vol 138 (21) ◽

pp. 211101 ◽

Author(s):

Robin Haunschild ◽

Lan Cheng ◽

Debashis Mukherjee ◽

Wim Klopper

Keyword(s):

Electron Correlation ◽

Correlation Correction ◽

Explicit Electron

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Vector Processing and Parallel Processing in Many—Body Perturbation Theory Calculations of Electron Correlation Effects in Atoms and Molecules

Supercomputational Science ◽

10.1007/978-1-4684-5820-6_16 ◽

1990 ◽

pp. 201-210 ◽

Author(s):

D. J. Baker ◽

S. Wilson ◽

D. Moncrieff

Keyword(s):

Perturbation Theory ◽

Parallel Processing ◽

Electron Correlation ◽

Correlation Effects ◽

Many Body ◽

Atoms And Molecules ◽

Vector Processing ◽

Many Body Perturbation Theory ◽

Electron Correlation Effects

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Contribution of triple substitutions to the electron correlation energy in fourth order perturbation theory

The Journal of Chemical Physics ◽

10.1063/1.439657 ◽

1980 ◽

Vol 72 (7) ◽

pp. 4244-4245 ◽

Author(s):

R. Krishnan ◽

M. J. Frisch ◽

J. A. Pople

Keyword(s):

Perturbation Theory ◽

Fourth Order ◽

Electron Correlation ◽

Correlation Energy ◽

Order Perturbation ◽

Order Perturbation Theory ◽

Electron Correlation Energy

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Perturbation theory of the electron correlation effects for atomic and molecular properties. V. Quadrupole polarizability of Ne

Physical Review A ◽

10.1103/physreva.27.2795 ◽

1983 ◽

Vol 27 (6) ◽

pp. 2795-2803 ◽

Author(s):

Geerd H. F. Diercksen ◽

Andrzej J. Sadlej

Keyword(s):

Perturbation Theory ◽

Electron Correlation ◽

Molecular Properties ◽

Correlation Effects ◽

Electron Correlation Effects

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A two-scale approach to electron correlation in multiconfigurational perturbation theory

Journal of Computational Chemistry ◽

10.1002/jcc.23666 ◽

2014 ◽

Vol 35 (22) ◽

pp. 1609-1617 ◽

Author(s):

Pooria Farahani ◽

Daniel Roca-Sanjuán ◽

Francesco Aquilante

Keyword(s):

Perturbation Theory ◽

Electron Correlation

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Systematic sequences of even-tempered Gaussian primitives in electron correlation studies using many-body perturbation theory

Theoretica Chimica Acta ◽

10.1007/bf00547996 ◽

1980 ◽

Vol 57 (1) ◽

pp. 53-61 ◽

Author(s):

Stephen Wilson

Keyword(s):

Perturbation Theory ◽

Electron Correlation ◽

Many Body ◽

Correlation Studies ◽

Many Body Perturbation Theory

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Stochastic many-body perturbation theory for electron correlation energies

The Journal of Chemical Physics ◽

10.1063/1.5128719 ◽

2019 ◽

Vol 151 (24) ◽

pp. 244114

Author(s):

Zhendong Li

Keyword(s):

Perturbation Theory ◽

Electron Correlation ◽

Many Body ◽

Many Body Perturbation Theory

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Intermolecular Interaction between Hexafluorobenzene and Benzene: Ab Initio Calculations Including CCSD(T) Level Electron Correlation Correction

The Journal of Physical Chemistry A ◽

10.1021/jp054461o ◽

2006 ◽

Vol 110 (5) ◽

pp. 2027-2033 ◽

Author(s):

Seiji Tsuzuki ◽

Tadafumi Uchimaru ◽

Masuhiro Mikami

Keyword(s):

Ab Initio Calculations ◽

Ab Initio ◽

Intermolecular Interaction ◽

Electron Correlation ◽

Correlation Correction

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Finite-field many-body perturbation theory II. SD-MBPT study of the nuclear charge dependence of the electron correlation contribution to the dipole polarizability of 10-electron atomic systems

Theoretica Chimica Acta ◽

10.1007/bf00549039 ◽

1982 ◽

Vol 61 (5) ◽

pp. 485-504 ◽

Author(s):

Geerd H. F. Diercksen ◽

Andrzej J. Sadlej

Keyword(s):

Perturbation Theory ◽

Finite Field ◽

Electron Correlation ◽

Nuclear Charge ◽

Dipole Polarizability ◽

Many Body ◽

Atomic Systems ◽

Charge Dependence ◽

Many Body Perturbation Theory

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Electron correlation effects on the static longitudinal second hyperpolarizability of polymeric chains. Mo/ller–Plesset perturbation theory investigation of hydrogen model chains

The Journal of Chemical Physics ◽

10.1063/1.472536 ◽

1996 ◽

Vol 105 (9) ◽

pp. 3592-3603 ◽

Author(s):

Benoı̂t Champagne ◽

David H. Mosley

Keyword(s):

Perturbation Theory ◽

Electron Correlation ◽

Correlation Effects ◽

Second Hyperpolarizability ◽

Polymeric Chains ◽

Electron Correlation Effects ◽

Plesset Perturbation Theory

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