Numerical evaluation of two-electron int
β
A. Henriet; C. Le Sech; F. Masnou-Seeuws
π
Article
π
1989
π
Elsevier Science
π
English
β 262 KB
In molecular systems such as alkali dimers the two-electron wavefunction can bc constructed using a limited number of configurations formed by products of two one-electron orbitals Q of the molecular ion. Starting from numerical values of the wavefunctions $ computed on a grid of points, we propose