https://publications-cnrc.canada.ca/fra/voir/objet/?id=9451be59-3ea2-42b7-9c80-b97412d89f92
Rechercher Yokogawa, Daisuke; Rechercher Sato, Hirofumi; Rechercher Gusarov, Sergey; Rechercher Kovalenko, Andriy
Canadian Journal of Chemistry, National Research Council of Canada. NRC Research Press, 28 novembre 2009, Volume : 87, Numéro : 12
We have developed an additive spherical site potential for exchange-repulsion energy by applying the local density approximation in Hilbert space, the...
Article de périodique (revue)