(Q45215753)

English

Density-functional theory-symmetry-adapted intermolecular perturbation theory with density fitting: a new efficient method to study intermolecular interaction energies

scientific article published in January 2005

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scholarly article

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Europe PubMed Central

PubMed publication ID

10 December 2017

Density-functional theory-symmetry-adapted intermolecular perturbation theory with density fitting: a new efficient method to study intermolecular interaction energies (English)

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Europe PubMed Central

PubMed publication ID

10 December 2017

perturbation theory

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author name string

Hesselmann A

1

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Europe PubMed Central

PubMed publication ID

10 December 2017

Jansen G

2

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Europe PubMed Central

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10 December 2017

Schütz M

3

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Europe PubMed Central

PubMed publication ID

10 December 2017

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publication date

1 January 2005

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Europe PubMed Central

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10 December 2017

Journal of Chemical Physics

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10 December 2017

122

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10 December 2017

1

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10 December 2017

14103

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Europe PubMed Central

PubMed publication ID

10 December 2017

A critical note on density functional theory studies on rare-gas dimers

1 reference

https://api.crossref.org/works/10.1063%2F1.1824898

21 January 2018

Perturbation Theory Approach to Intermolecular Potential Energy Surfaces of van der Waals Complexes

1 reference

https://api.crossref.org/works/10.1063%2F1.1824898

21 January 2018

Dispersion energy from density-functional theory description of monomers.

1 reference

https://api.crossref.org/works/10.1063%2F1.1824898

21 January 2018

Estimates of the ab initio limit for pi-pi interactions: the benzene dimer

1 reference

https://api.crossref.org/works/10.1063%2F1.1824898

21 January 2018

Generalized Gradient Approximation Made Simple

1 reference

https://api.crossref.org/works/10.1063%2F1.1824898

21 January 2018

Second-order Møller-Plesset theory with linear R12 terms (MP2-R12) revisited: auxiliary basis set method and massively parallel implementation.

1 reference

https://api.crossref.org/works/10.1063%2F1.1824898

21 January 2018

Fast linear scaling second-order Møller-Plesset perturbation theory (MP2) using local and density fitting approximations

1 reference

https://api.crossref.org/works/10.1063%2F1.1824898

21 January 2018

Potential Energy Surface for the Benzene Dimer. Results ofab InitioCCSD(T) Calculations Show Two Nearly Isoenergetic Structures: T-Shaped and Parallel-Displaced

1 reference

https://api.crossref.org/works/10.1063%2F1.1824898

21 January 2018

A purely ab initio spectroscopic quality quartic force field for acetylene

1 reference

https://api.crossref.org/works/10.1063%2F1.1824898

21 January 2018

Identifiers

10.1063/1.1824898

1 reference

Europe PubMed Central

PubMed publication ID

10 December 2017

PubMed publication ID

1 reference

Europe PubMed Central

PubMed publication ID

10 December 2017

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