Gatti, F
Iung, C.
Leforestier, C
Menou, M
Justum, Y
Nauts, André
[UCL]
Chapuisat, X.
It is shown that the geometrical description of a three-atom molecular system by two Jacobi relative position vectors is, within the framework of an adequate representation, particularly advantageous with regard to the criterion of maximal pre-diagonalization of the matrix representing the kinetic energy operator. (C) 1998 Elsevier Science B.V.
Bibliographic reference |
Gatti, F ; Iung, C. ; Leforestier, C ; Menou, M ; Justum, Y ; et. al. Vector parametrization of the three-atom problem in quantum mechanics. In: Journal of Molecular Structure: THEOCHEM, Vol. 424, no. 1-2, p. 181-199 (1998) |
Permanent URL |
http://hdl.handle.net/2078.1/45475 |