(Q27345431)

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Optimization of Effective Atom Centered Potentials for London Dispersion Forces in Density Functional Theory

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Optimization of effective atom centered potentials for london dispersion forces in density functional theory

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title

Optimization of Effective Atom Centered Potentials for London Dispersion Forces in Density Functional Theory (English)

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main subject

density functional theory

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3

Ursula Rothlisberger

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author name string

O. Anatole von Lilienfeld

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1

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Ivano Tavernelli

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2

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Daniel Sebastiani

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4

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language of work or name

English

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publication date

7 October 2004

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October 2004

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published in

Physical Review Letters

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PubMed

volume

93

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issue

15

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page(s)

153004

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cites work

Dispersion energy from density-functional theory description of monomers.

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https://api.crossref.org/works/10.1103%2FPHYSREVLETT.93.153004

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21 January 2018

Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density

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https://api.crossref.org/works/10.1103%2FPHYSREVLETT.93.153004

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21 January 2018

A New Approximation Method in the Problem of Many Electrons

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reference URL

https://api.crossref.org/works/10.1103%2FPHYSREVLETT.93.153004

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21 January 2018

Pseudopotentials that work: From H to Pu

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https://api.crossref.org/works/10.1103%2FPHYSREVLETT.93.153004

retrieved

21 January 2018

Pseudopotential methods in condensed matter applications

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https://api.crossref.org/works/10.1103%2FPHYSREVLETT.93.153004

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21 January 2018

Direct method for optimized effective potentials in density-functional theory.

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https://api.crossref.org/works/10.1103%2FPHYSREVLETT.93.153004

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21 January 2018

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

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reference URL

https://api.crossref.org/works/10.1103%2FPHYSREVLETT.93.153004

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21 January 2018

Identifiers

DOI

10.1103/PHYSREVLETT.93.153004

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PubMed publication ID

15524874

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(Q27345431)

Optimization of Effective Atom Centered Potentials for London Dispersion Forces in Density Functional Theory

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