Temperature and isotope effects on water cluster ions with path integral molecular dynamics based on the fourth order Trotter expansion
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.2987445
Reference23 articles.
1. Mechanism of hydroxide mobility
2. Characterization of Excess Electrons in Water-Cluster Anions by Quantum Simulations
3. The nature of the hydrated excess proton in water
4. Ab initio molecular dynamics simulation of the solvation and transport of hydronium and hydroxyl ions in water
5. The quantum dynamics of an excess proton in water
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