Fully nonadiabatic properties of all H2 isotopomers.
Using variational Monte Carlo and simple explicitly correlated fully nonadiabatic wavefunctions we have computed the energy and 29 properties of the lowest rovibrational state of all the H(2) isotopomers. Our results are in very good agreement with previous calculations on these systems.
Alexander
S A
SA
Department of Physics, Southwestern University, Georgetown, Texas 78626, USA. alexands@southwestern.edu
Coldwell
R L
RL