Electronic structure and isomer shifts of Sn halides

Joice Terra and Diana Guenzburger
Phys. Rev. B 39, 50 – Published 1 January 1989
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Abstract

The all-electron first-principles discrete variational method was employed to study the electronic structure of SnF4, SnCl4, SnBr4, and SnI4. Values of the electronic density at the Sn nucleus were derived and related to Sn119 isomer shifts to obtain the nuclear constant Δ〈r2〉. Differences in values of ρ(0) are discussed in terms of the chemical bonding between Sn and halogen atoms.

  • Received 29 August 1988

DOI:https://doi.org/10.1103/PhysRevB.39.50

©1989 American Physical Society

Authors & Affiliations

Joice Terra and Diana Guenzburger

  • Centro Brasileiro de Pesquisas Fiiaasicas (CBPF), Conselho Nacional de Desenvolvimento Cientiiaafico e Tecnológico (CNPq), Rua Dr. Xavier Sigaud, 150, 22290, Rio de Janeiro, Rio de Janeiro, Brazil

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Vol. 39, Iss. 1 — 1 January 1989

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