Interaction potentials of LiH, NaH, KH, RbH, and CsH

N. Geum; G. H. Jeung; A. Derevianko; R. Côté; A. Dalgarno

doi:10.1063/1.1388044

Interaction potentials of LiH, NaH, KH, RbH, and CsH

N. Geum
, G. H. Jeung
, A. Derevianko
, R. Côté
, A. Dalgarno

Physics

Dankook University
Laboratoire Aimé Cotton
University of Nevada, Reno
University of Connecticut
60 Garden Street

Research output: Contribution to journal › Article › peer-review

Abstract

Ab initio calculations of the potential energy curves of the singlet and triplet states of LiH, NaH, KH, RbH, and CsH formed by the approach of ground state alkali-metal atoms and hydrogen atoms were carried out. Based on the results, hybrid potentials were constructed. The resulting potentials will enable accurate predictions to be made of the scattering of the alkali metal atoms by hydrogen atoms.

Original language	English
Pages (from-to)	5984-5988
Number of pages	5
Journal	Journal of Chemical Physics
Volume	115
Issue number	13
DOIs	https://doi.org/10.1063/1.1388044
State	Published - Oct 1 2001

ASJC Scopus Subject Areas

General Physics and Astronomy
Physical and Theoretical Chemistry

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10.1063/1.1388044

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abstract = "Ab initio calculations of the potential energy curves of the singlet and triplet states of LiH, NaH, KH, RbH, and CsH formed by the approach of ground state alkali-metal atoms and hydrogen atoms were carried out. Based on the results, hybrid potentials were constructed. The resulting potentials will enable accurate predictions to be made of the scattering of the alkali metal atoms by hydrogen atoms.",

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AU - Geum, N.

AU - Jeung, G. H.

AU - Derevianko, A.

AU - Côté, R.

AU - Dalgarno, A.

PY - 2001/10/1

Y1 - 2001/10/1

N2 - Ab initio calculations of the potential energy curves of the singlet and triplet states of LiH, NaH, KH, RbH, and CsH formed by the approach of ground state alkali-metal atoms and hydrogen atoms were carried out. Based on the results, hybrid potentials were constructed. The resulting potentials will enable accurate predictions to be made of the scattering of the alkali metal atoms by hydrogen atoms.

AB - Ab initio calculations of the potential energy curves of the singlet and triplet states of LiH, NaH, KH, RbH, and CsH formed by the approach of ground state alkali-metal atoms and hydrogen atoms were carried out. Based on the results, hybrid potentials were constructed. The resulting potentials will enable accurate predictions to be made of the scattering of the alkali metal atoms by hydrogen atoms.

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Interaction potentials of LiH, NaH, KH, RbH, and CsH

Abstract

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