Browsing Department of Chemistry Faculty Publications by Subject "Water Dimer"
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Using Monomer Vibrational Wavefunctions to Compute Numerically Exact (12D) Rovibrational Levels of Water Dimer (2017)We compute numerically exact rovibrational levels of water dimer, with 12 vibrational coordinates, on the accurate CCpol-8sf ab initio ﬂexible monomer potential energy surface[J. Chem. Phys. 137, 014305 (2012)]. It does ...