(Q33613933)

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Fast computation of molecular random phase approximation correlation energies using resolution of the identity and imaginary frequency integration.

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https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:20572696%20AND%20SRC:MED&resulttype=core&format=json

6 February 2020

Fast computation of molecular random phase approximation correlation energies using resolution of the identity and imaginary frequency integration (English)

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Europe PubMed Central

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https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:20572696%20AND%20SRC:MED&resulttype=core&format=json

6 February 2020

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6 February 2020

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Henk Eshuis

1

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6 February 2020

Julian Yarkony

2

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6 February 2020

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1 June 2010

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6 February 2020

Journal of Chemical Physics

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6 February 2020

132

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6 February 2020

23

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6 February 2020

234114

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6 February 2020

Describing static correlation in bond dissociation by Kohn-Sham density functional theory

1 reference

https://api.crossref.org/works/10.1063%2F1.3442749

21 January 2018

The ground state correlation energy of the random phase approximation from a ring coupled cluster doubles approach

1 reference

https://api.crossref.org/works/10.1063%2F1.3442749

21 January 2018

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

1 reference

https://api.crossref.org/works/10.1063%2F1.3442749

21 January 2018

Adiabatic-connection fluctuation-dissipation density-functional theory based on range separation.

1 reference

https://api.crossref.org/works/10.1063%2F1.3442749

21 January 2018

Long-range-corrected hybrids including random phase approximation correlation

1 reference

https://api.crossref.org/works/10.1063%2F1.3442749

21 January 2018

Long-range-corrected hybrid density functionals including random phase approximation correlation: application to noncovalent interactions

1 reference

https://api.crossref.org/works/10.1063%2F1.3442749

21 January 2018

Hybrid functionals including random phase approximation correlation and second-order screened exchange

1 reference

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21 January 2018

Developing the random phase approximation into a practical post-Kohn-Sham correlation model.

1 reference

https://api.crossref.org/works/10.1063%2F1.3442749

21 January 2018

Analytical time-dependent density functional derivative methods within the RI-J approximation, an approach to excited states of large molecules

1 reference

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21 January 2018

New Methods For Electronic Structure Calculations on Large Molecules

1 reference

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21 January 2018

Pseudospectral time-dependent density functional theory.

1 reference

https://api.crossref.org/works/10.1063%2F1.3442749

21 January 2018

Computing $A^\alpha, \log(A)$, and Related Matrix Functions by Contour Integrals

1 reference

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21 January 2018

Scaled opposite-spin second order Møller-Plesset correlation energy: an economical electronic structure method

1 reference

https://api.crossref.org/works/10.1063%2F1.3442749

21 January 2018

RI-MP2: first derivatives and global consistency

1 reference

https://api.crossref.org/works/10.1063%2F1.3442749

21 January 2018

Generalized Gradient Approximation Made Simple

1 reference

https://api.crossref.org/works/10.1063%2F1.3442749

21 January 2018

Gaussian basis sets for use in correlated molecular calculations. I. The atoms boron through neon and hydrogen

1 reference

https://api.crossref.org/works/10.1063%2F1.3442749

21 January 2018

Balanced basis sets of split valence, triple zeta valence and quadruple zeta valence quality for H to Rn: Design and assessment of accuracy.

1 reference

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21 January 2018

Hartree-Fock exchange fitting basis sets for H to Rn.

1 reference

https://api.crossref.org/works/10.1063%2F1.3442749

21 January 2018

Correlation potential in density functional theory at the GWA level: Spherical atoms

1 reference

https://api.crossref.org/works/10.1063%2F1.3442749

21 January 2018

RI-MP2: optimized auxiliary basis sets and demonstration of efficiency

1 reference

https://api.crossref.org/works/10.1063%2F1.3442749

21 January 2018

Efficient use of the resolution of the identity approximation in time-dependent density functional calculations with hybrid density functionals

1 reference

https://api.crossref.org/works/10.1063%2F1.3442749

21 January 2018

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

1 reference

https://api.crossref.org/works/10.1063%2F1.3442749

21 January 2018

Identifiers

10.1063/1.3442749

1 reference

Europe PubMed Central

PubMed publication ID

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:20572696%20AND%20SRC:MED&resulttype=core&format=json

6 February 2020

PubMed publication ID

1 reference

Europe PubMed Central

PubMed publication ID

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:20572696%20AND%20SRC:MED&resulttype=core&format=json

6 February 2020

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