B. Hupper et B. Eckhardt, Uniform semiclassical calculation of the direct part of the photodissociation cross section of water, J CHEM PHYS, 110(24), 1999, pp. 11749-11755
The photodissociation cross section of water in the first absorption band n
aturally splits into two parts, a rather dominant and broad background, and
a series of isolated resonances. We focus here on the semiclassical calcul
ation of the background term. We compare various semiclassical methods of c
alculation, including the reflection approximation, the Wigner-Weyl series,
Airy function approximations, and higher-order approximations in the time
domain, and find that only the latter gives quantitative agreement. They ar
e numerically efficient as they can be reduced to a 2-D spatial integration
together with a Fourier transform. (C) 1999 American Institute of Physics.
[S0021-9606(99)00224-X].