Abstract
ODIN, a non-empirical INDO-MO scheme, has been used to determine the ground state electronic configurations for the tetrahedral molecules, VCl4 and VBr4. A 2 E ground state was obtained for both molecules. The Photoelectron spectrum and the electronic spectrum have been calculated for VCl4, and a satisfactory correlation with the corresponding experimental data was made. Also, ODIN was employed to evaluate electronic transition energies and the photoelectron spectrum of VBr4.
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Truax, D.R., Geer, J.A. & Ziegler, T. Non-empirical INDO-MO calculations on some vanadium(IV) halides. Theoret. Chim. Acta 33, 299–306 (1974). https://doi.org/10.1007/BF00551157
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DOI: https://doi.org/10.1007/BF00551157