(Q58228076)

English

The CIPT2 method: Coupling of multi-reference configuration interaction and multi-reference perturbation theory. Application to the chromium dimer

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scholarly article

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The CIPT2 method: Coupling of multi-reference configuration interaction and multi-reference perturbation theory. Application to the chromium dimer (English)

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1 reference

based on heuristic

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perturbation theory

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author name string

P. Celani

1

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H. Stoll

2

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H.-J. Werner

3

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P.J. Knowles *

4

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publication date

10 November 2004

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Molecular Physics

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102

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2369-2379

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21-22

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The "sextuple" bond of chromium dimer

1 reference

https://api.crossref.org/works/10.1080%2F00268970412331317788

21 January 2018

Modified Generalized Valence-Bond Method: A Simple Correction for the Electron Correlation Missing in Generalized Valence-Bond Wave Functions; Prediction of Double-Well States for Cr 2 and Mo 2

1 reference

https://api.crossref.org/works/10.1080%2F00268970412331317788

21 January 2018

N-electron valence state perturbation theory: a fast implementation of the strongly contracted variant

1 reference

https://api.crossref.org/works/10.1080%2F00268970412331317788

21 January 2018

n-electron valence state perturbation theory: A spinless formulation and an efficient implementation of the strongly contracted and of the partially contracted variants

1 reference

https://api.crossref.org/works/10.1080%2F00268970412331317788

21 January 2018

An efficient internally contracted multiconfiguration–reference configuration interaction method

1 reference

https://api.crossref.org/works/10.1080%2F00268970412331317788

21 January 2018

The self‐consistent electron pairs method for multiconfiguration reference state functions

1 reference

https://api.crossref.org/works/10.1080%2F00268970412331317788

21 January 2018

Configuration interaction calculations on the nitrogen molecule

1 reference

https://api.crossref.org/works/10.1080%2F00268970412331317788

21 January 2018

The calculation of small molecular interactions by the differences of separate total energies. Some procedures with reduced errors

1 reference

https://api.crossref.org/works/10.1080%2F00268970412331317788

21 January 2018

Identifiers

10.1080/00268970412331317788

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