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20022024
most citedOn the accuracy of the MB-pol many-body potential for water: Interaction energies, vibrational frequencies, and classical thermodynamic and dynamical properties from clusters to liquid water and ice

295 citations · 1.1k across the 15 of their papers we have counts for

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physics.atm-clus2003★ 48 cited

OCS in small para-hydrogen clusters: energetics and structure with N=1-8 complexed hydrogen molecules

F. Paesani, R. E. Zillich, K. B. Whaley

We determine the structure and energetics of complexes of the linear OCS molecule with small numbers of para-hydrogen molecules, N=1-8, using zero temperature quantum Monte Carlo m…