Dispersion and repulsion contributions to the solvation free energy: Comparison of quantum mechanical and classical approaches in the polarizable continuum model.

Carles Curutchet Modesto Orozco F. Javier Luque Benedetta Mennucci Jacopo Tomasi Dispersion and repulsion contributions to the solvation free energy: Comparison of quantum mechanical and classical approaches in the polarizable continuum model. 1769-1780 2006 27 Journal of Computational Chemistry 15 http://dx.doi.org/10.1002/jcc.20480 db/journals/jcc/jcc27.html#CurutchetOLMT06