Large-Scale Cubic-Scaling Random Phase Approximation Correlation Energy Calculations Using a Gaussian Basis

Jan Wilhelm; Patrick Seewald; Mauro Del Ben; Jürg Hutter

doi:10.1021/acs.jctc.6b00840

Large-Scale Cubic-Scaling Random Phase Approximation Correlation Energy Calculations Using a Gaussian Basis

Journal of Chemical Theory and Computation ◽

10.1021/acs.jctc.6b00840 ◽

2016 ◽

Vol 12 (12) ◽

pp. 5851-5859 ◽

Cited By ~ 33

Author(s):

Jan Wilhelm ◽

Patrick Seewald ◽

Mauro Del Ben ◽

Jürg Hutter

Keyword(s):

Random Phase Approximation ◽

Large Scale ◽

Correlation Energy ◽

Random Phase ◽

Phase Approximation ◽

Energy Calculations

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Staggered Mesh Method for Correlation Energy Calculations of Solids: Random Phase Approximation in Direct Ring Coupled Cluster Doubles and Adiabatic Connection Formalisms

Journal of Chemical Theory and Computation ◽

10.1021/acs.jctc.1c00985 ◽

2022 ◽

Author(s):

Xin Xing ◽

Lin Lin

Keyword(s):

Random Phase Approximation ◽

Correlation Energy ◽

Random Phase ◽

Coupled Cluster ◽

Phase Approximation ◽

Energy Calculations ◽

Mesh Method

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Communication: Two-component ring-coupled-cluster computation of the correlation energy in the random-phase approximation

The Journal of Chemical Physics ◽

10.1063/1.4832738 ◽

2013 ◽

Vol 139 (19) ◽

pp. 191102 ◽

Cited By ~ 5

Author(s):

Katharina Krause ◽

Wim Klopper

Keyword(s):

Random Phase Approximation ◽

Correlation Energy ◽

Random Phase ◽

Coupled Cluster ◽

Phase Approximation ◽

Two Component

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Basis set convergence of molecular correlation energy differences within the random phase approximation

The Journal of Chemical Physics ◽

10.1063/1.3687005 ◽

2012 ◽

Vol 136 (8) ◽

pp. 084105 ◽

Cited By ~ 73

Author(s):

Henk Eshuis ◽

Filipp Furche

Keyword(s):

Random Phase Approximation ◽

Correlation Energy ◽

Random Phase ◽

Basis Set ◽

Phase Approximation ◽

Set Convergence ◽

Molecular Correlation

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Random-phase-approximation-based correlation energy functionals: Benchmark results for atoms

The Journal of Chemical Physics ◽

10.1063/1.2795707 ◽

2007 ◽

Vol 127 (18) ◽

pp. 184108 ◽

Cited By ~ 75

Author(s):

Hong Jiang ◽

Eberhard Engel

Keyword(s):

Random Phase Approximation ◽

Correlation Energy ◽

Random Phase ◽

Phase Approximation ◽

Energy Functionals

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Comparison of multiconfiguration Dirac-Fock and multiconfiguration relativistic random-phase-approximation transition-energy calculations in the beryllium isoelectronic sequence

Physical Review A ◽

10.1103/physreva.29.2220 ◽

1984 ◽

Vol 29 (4) ◽

pp. 2220-2221 ◽

Cited By ~ 4

Author(s):

D. Frye ◽

Lloyd Armstrong

Keyword(s):

Random Phase Approximation ◽

Transition Energy ◽

Random Phase ◽

Phase Approximation ◽

Isoelectronic Sequence ◽

Energy Calculations

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Molecular tests of the random phase approximation to the exchange-correlation energy functional

Physical Review B ◽

10.1103/physrevb.64.195120 ◽

2001 ◽

Vol 64 (19) ◽

Cited By ~ 343

Author(s):

Filipp Furche

Keyword(s):

Random Phase Approximation ◽

Correlation Energy ◽

Random Phase ◽

Energy Functional ◽

Phase Approximation ◽

Exchange Correlation ◽

Molecular Tests

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Exchange-correlation energy from pairing matrix fluctuation and the particle-particle random-phase approximation

Physical Review A ◽

10.1103/physreva.88.030501 ◽

2013 ◽

Vol 88 (3) ◽

Cited By ~ 58

Author(s):

Helen van Aggelen ◽

Yang Yang ◽

Weitao Yang

Keyword(s):

Random Phase Approximation ◽

Correlation Energy ◽

Random Phase ◽

Phase Approximation ◽

Exchange Correlation

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Accelerate stochastic calculation of random-phase approximation correlation energy difference with an atom-based correlated sampling

Electronic Structure ◽

10.1088/2516-1075/abde94 ◽

2021 ◽

Author(s):

Yu-Chieh Chi ◽

Chen Huang

Keyword(s):

Random Phase Approximation ◽

Correlation Energy ◽

Random Phase ◽

Energy Difference ◽

Phase Approximation ◽

Correlated Sampling

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Publisher's Note: Convergence behavior of the random phase approximation renormalized correlation energy [Phys. Rev. B 95 , 195158 (2017)]

Physical Review B ◽

10.1103/physrevb.97.039905 ◽

2018 ◽

Vol 97 (3) ◽

Author(s):

Jefferson E. Bates ◽

Jonathon Sensenig ◽

Adrienn Ruzsinszky

Keyword(s):

Random Phase Approximation ◽

Correlation Energy ◽

Random Phase ◽

Phase Approximation ◽

Convergence Behavior

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Random phase approximation correlation energy using a compact representation for linear response functions: application to solids

Journal of Physics Condensed Matter ◽

10.1088/0953-8984/28/3/035201 ◽

2016 ◽

Vol 28 (3) ◽

pp. 035201 ◽

Cited By ~ 8

Author(s):

Fawzi Kaoui ◽

Dario Rocca

Keyword(s):

Linear Response ◽

Random Phase Approximation ◽

Correlation Energy ◽

Random Phase ◽

Compact Representation ◽

Phase Approximation ◽

Response Functions

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