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Hyperfine Structure Constants for Diatomic Molecules

The multiconfiguration valence-bond method (VB) is applied to diatomic molecules using the Hartree-Fock (HF) atomic basis set. The hyperfine constant, Fermi contact term, is computed as a function of the interatomic separation for the X(2)∏ ground state of (17)OH and X(1)∑ ground state of (107)AgH(+...

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Dades bibliogràfiques
Publicat a:J Res Natl Inst Stand Technol
Autors principals: Tupitsyn, I., Kotochigova, S.
Format: Artigo
Idioma:Inglês
Publicat: [Gaithersburg, MD] : U.S. Dept. of Commerce, National Institute of Standards and Technology 1998
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Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC4890948/
https://ncbi.nlm.nih.gov/pubmed/28009357
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.6028/jres.103.014
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