Ab initio SCF and CI study of the electr
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A.B. Sannigrahi; S.D. Peyerimhoff
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Article
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1985
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Elsevier Science
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English
β 352 KB
Ab milio SCF and CI calculations usmg a double-zeta plus polarrwr~on bans SIX hdx,s been prrlormed on the chlorms difluoride cation (GIFT ) and the anion (CIF; ) to determine [heir ground-slate electrontc structure The ClF;l ran IF predfcwd lo have a suongly benr (G,) swucmre (bond angle -Leo) and t