Logo image
Se connecter
Solvation effects on reaction profiles by the polarizable continuum model coupled with the Gaussian density functional method
Article de revue   Avec comité de lecture

Solvation effects on reaction profiles by the polarizable continuum model coupled with the Gaussian density functional method

Tzonka Mineva, Nino Russo et Emilia Sicilia
Journal of computational chemistry, Vol.19(3), pp.290-299
02/1998

Résumé

density functional hydration energy polarizable continuum model (PCM) reaction profiles solvation

Indicateurs

1 Consultations de la notice

Détails

Logo image