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DVM-Xα calculations on the ionization potentials of MXk+1− complex anions and the electron affinities of MXk+1 “superhalogens”

✍ Scribed by G.L. Gutsev; A.I. Boldyrev


Publisher
Elsevier Science
Year
1981
Tongue
English
Weight
822 KB
Volume
56
Category
Article
ISSN
0301-0104

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## Abstract MS‐__X__α calculations have been performed for the neutral species and the transition states for the positive and negative ions of the heavy metal atoms Mo, W, Re, Ir, Pt, and U and their diatomic hydrides and fluorides. Both nonspin‐polarized and spin‐polarized calculations were perfor