C. Tablero et al., Global nine-dimensional potential energy surface for the H-5 system. II. Fit to an analytical expression, J CHEM PHYS, 110(16), 1999, pp. 7796-7801
A global nine-dimensional potential energy surface (GPES) for the adiabatic
ground state of the H-5 system which fits the ab initio data, reported in
the previous paper of this series, has been obtained (root-mean-square erro
r 2.2 kcal/mol). The global fitting procedure is an extension of the corres
ponding procedure for triatomic and tetra-atomic systems including the func
tional form previously proposed by the authors. The H-5 GPES obtained here
is totally symmetric with respect to permutations of the hydrogen atoms and
satisfies the criteria needed to be used in scattering calculations. (C) 1
999 American Institute of Physics. [S0021-9606(99)30816-3].