β Scribed by Aleksey B. Alekseyev; Heinz-Peter Liebermann; Robert J. Buenker; Gerhard Hirsch
No coin nor oath required. For personal study only.
π SIMILAR VOLUMES
A s:udy of electron coliisions with ground-state CO2 mo!ecules in the energy range 0.07-lr3.0 eV is reported. An accurate static potential is augmented with a local exchange potential and induced polarization terms, and coupled radial equations are solved in a spherical coordinate system. Converged
The ground 'Zg', the lowest t311, t3A and '-%-excited states of the AsN molecule have been calculated using a double-zeta + polarization + diffuse basis set, large CI and non-empirical pseudopotentials. Agreement with experimental ';. oe and transition energies is good. The calculated D\_\_ is 4.22
The electronic spectrum of thiophene has been studied using multiconfiguration second-order perturbation theory and extended AN0 basis sets. The calculations comprise four singlet valence excited states and the 3s3p3d Rydberg series. The lowest triplet states were included and some n-n\* and n-ti st