Water 26-mers Drawn from Bulk Simulations: Benchmark Binding Energies for Unprecedentedly Large Water Clusters and Assessment of the Electrostatically Embedded Three-Body and Pairwise Additive Approximations

Document Details

Document Type
Pub Defense Publication
Publication Date
Feb 03, 2014
Source ID
10.1021/jz500079e

Entities

People

  • Donald Truhlar
  • Hannah R. Leverentz
  • Haoyu Yu
  • J. Ilja Siepmann
  • Joachim Friedrich
  • Peng Bai

Organizations

  • Air Force Office of Scientific Research
  • Chemnitz University of Technology
  • University of Minnesota