Solution reaction space Hamiltonian based on an electrostatic potential representation of solvent dynamics
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.3572057
Reference81 articles.
1. Molecular Interactions in Solution: An Overview of Methods Based on Continuous Distributions of the Solvent
2. Quantum Mechanical Continuum Solvation Models
3. Implicit Solvation Models: Equilibria, Structure, Spectra, and Dynamics
4. Continuum Solvation Models in Chemical Physics
5. Solvation Effects on Molecules and Biomolecules
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