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Development of a first principles water potential with flexible monomers: Dimer potential energy surface, VRT spectrum, and second virial coefficient
Journal article   Peer reviewed

Development of a first principles water potential with flexible monomers: Dimer potential energy surface, VRT spectrum, and second virial coefficient

Claude Leforestier, Francesco Paesani and Volodymir Babin
Journal of Chemical Theory and Computation, Vol.9
14/11/2013
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