Spin–Orbit Effect on the Molecular Properties of TeXn (X = F, Cl, Br, and I; n = 1, 2, and 4): A Density Functional Theory and Ab Initio Study
Author:
Affiliation:
1. Department of Chemistry, The Catholic University of Korea, Bucheon 14662, Republic of Korea
Funder
National Research Foundation of Korea
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.6b06176
Reference32 articles.
1. A Combined Gas‐Phase Electron Diffraction/Mass Spectrometric Study of the Sublimation Processes of TeBr 4 and TeI 4 : The Molecular Structure of Tellurium Dibromide and Tellurium Diiodide
2. The structures of tellurium(iv) halides in the gas phase and as solvated molecules
3. Gas phase structures of chalcogen tetrahalides MX4 with M = S, Se, Te and X = F, Cl, Br, I
4. Crystal Structure of ClF4+SbF6-, Normal Coordinate Analyses of ClF4+, BrF4+, IF4+, SF4, SeF4, and TeF4, and Simple Method for Calculating the Effects of Fluorine Bridging on the Structure and Vibrational Spectra of Ions in a Strongly Interacting Ionic Solid
5. Spin–orbit effects for the diatomic molecules containing halogen elements studied with relativistic effective core potentials: HX, X2 (X=Cl, Br and I) and IZ (Z=F, Cl and Br) molecules
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