(Q51541655)

6 April 2018

title

A new internally contracted multi-reference configuration interaction method. (English)

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author

Hans-Joachim Werner

series ordinal

3

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author name string

K R Shamasundar

series ordinal

1

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Gerald Knizia

series ordinal

2

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language of work or name

English

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publication date

1 August 2011

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Journal of Chemical Physics

published in

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volume

135

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issue

5

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page(s)

054101

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Molecular Electronic-Structure Theory

cites work

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An efficient internally contracted multiconfiguration–reference configuration interaction method

21 January 2018

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An efficient method for the evaluation of coupling coefficients in configuration interaction calculations

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Internally contracted multiconfiguration-reference configuration interaction calculations for excited states

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Stereoelectronic Effects on Molecular Geometries and State-Energy Splittings of Ligated Monocopper Dioxygen Complexes

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Identifiers

DOI

10.1063/1.3609809

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