Analytic energy gradients for the Gaussian very fast multipole method (GvFMM)

Autor: Burant, J. C., Strain, M. C., Scuseria, G. E., Frisch, M. J.
Zdroj: Chemical Physics Letters; 1996, Vol. 248 Issue: 1 p43-49, 7p
Databáze: Supplemental Index