V. Boudon et F. Michelot, SPECTROSCOPY OF HEXAFLUORIDES WITH AN ODD NUMBER OF ELECTRONS - A TENSORIAL FORMALISM ADAPTED TO THE CHAIN SU(2)CIRCLE-TIMES-C(1)SUPERSET-OF-O(H)(S), Journal of molecular spectroscopy, 165(2), 1994, pp. 554-579
Citations number
18
Categorie Soggetti
Spectroscopy,"Physics, Atomic, Molecular & Chemical
A tensorial formalism adapted to the case of octahedral molecules or m
olecular ions with half-integer angular momenta is proposed as an ''te
nsion of the usual formalism for the group chain 0(3) superset-of O(h)
. We use the chain SU(2) x C(I) superset-of O(h)S, where O(h)S is the
octahedral group with its spinorial representations. Coupling coeffici
ents (3j - m, isoscalar factors, etc.) and formulas for the computatio
n of matrix elements of tensor operators are derived for this chain. A
deduction of coupling coefficients (3C - sigma, 6C, . . .) and simila
r formulas is proposed for the non-simply reducible group O(S) itself.
(C) 1994 Academic Press, Inc.