Coupled-cluster, Möller Plesset (MP2), density fitted local MP2, and density functional theory examination of the energetic and structural features of hydrophobic solvation: Water and pentane
Author:
Funder
U.S. Department of Energy
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.3679933
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1. The Hydrophobic Effect and the Influence of Solute−Solvent Attractions
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4. Orientation, Hydrogen Bonding, and Penetration of Water at the Organic/Water Interface
5. Vibrational Sum-Frequency Spectroscopy of Alkane/Water Interfaces: Experiment and Theoretical Simulation
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