London dispersion forces by range separated hybrid density functional with second order perturbational corrections (RSH+MP2): the case of rare gas complexes

I.C. Gerber , J.G. Ángyán (1)

1 LCM3B - Laboratoire de Cristallographie et modélisation des matériaux minéraux et biologiques

Domaines: Autre [cond-mat.other]

I.C. Gerber, J.G. Ángyán. London dispersion forces by range separated hybrid density functional with second order perturbational corrections (RSH+MP2): the case of rare gas complexes. Journal of Chemical Physics, 2007, 126, pp.044103. ⟨hal-00207473⟩