Coupled Cluster Calculations of the Ground and Excited Electronic States Using Two- and Four-Component Relativistic Spinors

Please use this identifier to cite or link to this item: http://hdl.handle.net/2248/3896

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DC Field	Value	Language
dc.contributor.author	Chaudhuri, R. K	-
dc.date.accessioned	2008-09-25T13:33:00Z	-
dc.date.available	2008-09-25T13:33:00Z	-
dc.date.issued	2003-12	-
dc.identifier.citation	International Journal of Molecular Sciences, Vol. 4, No. 12, pp. 586 - 594	en
dc.identifier.issn	1422-0067	-
dc.identifier.uri	http://hdl.handle.net/2248/3896	-
dc.description.abstract	The coupled cluster based linear response theory which is applicable to the direct calculation of atomic and molecular properties are presented and applied to compute the ionization potentials and excitation energies of light and moderately heavy atoms. The e®ect of electron correlation on the ground and excited states is studied using Hartree-Fock, Dirac-Fock and approximate two-component relativistic spinors.	en
dc.language.iso	en	en
dc.publisher	Molecular Diversity Preservation International	en
dc.relation.uri	http://www.mdpi.org/ijms/papers/i4120586.pdf	-
dc.subject	Standard Model	en
dc.subject	Model space	en
dc.subject	Kinetic balance	en
dc.subject	Variational collapse	en
dc.subject	HF	en
dc.subject	DF	en
dc.subject	RESC	en
dc.subject	CCM and CCLRT	en
dc.title	Coupled Cluster Calculations of the Ground and Excited Electronic States Using Two- and Four-Component Relativistic Spinors	en
dc.type	Article	en
Appears in Collections:	IIAP Publications

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