Ab initio characterization of the structure and energetics of the ArHF complex

van Mourik, Tanja; Dunning Jr., Thom H.
August 1997
Journal of Chemical Physics;8/15/1997, Vol. 107 Issue 7, p2451
Academic Journal
Studies the structure and energetics of the ArHF complex using correlation consistent basis sets at several levels of theory. Moller-Plesset perturbation theory; Couple cluster techniques; Characterization of the stationary points on the counterpoise-corrected potential energy surface.


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