Electronic structure parameter of nuclear magnetic quadrupole moment interaction in metal monofluorides

TitleElectronic structure parameter of nuclear magnetic quadrupole moment interaction in metal monofluorides
Publication TypeJournal Article
Year of Publication2020
AuthorsTalukdar, K, Nayak, MK, Vaval, N, Pal, S
JournalJournal of Chemical Physics
Volume153
Issue18
Pagination184306
Date PublishedNOV
Type of ArticleArticle
ISSN0021-9606
Abstract

The electronic structure parameter (W-M) of the nuclear magnetic quadrupole moment (MQM) interaction in numerous open-shell metal monofluorides (viz., MgF, CaF, SrF, BaF, RaF, and PbF) is computed in the fully relativistic coupled-cluster framework. The electron-correlation effects are found to be very important for the precise calculation of W-M in the studied molecular systems. The molecular MQM interaction parameter scales nearly as Z(2) in the alkaline earth metal monofluorides, where Z is the nuclear charge of metal. Our study identifies (RaF)-Ra-223 as a good candidate for the experimental search of the nuclear MQM, which can help unravel the physics beyond the standard model in the hadron sector of matter.

DOI10.1063/5.0028669
Type of Journal (Indian or Foreign)

Foreign

Impact Factor (IF)

2.991

Divison category: 
Physical and Materials Chemistry

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