Simulation of proton transfer along ammonia wires: An “ab...

Simulation of proton transfer along ammonia wires: An “ab initio” and semiempirical density functional comparison of potentials and classical molecular dynamics

Meuwly, Markus, Karplus, Martin
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Volume:
116
Year:
2002
Language:
english
Journal:
The Journal of Chemical Physics
DOI:
10.1063/1.1431285
File:
PDF, 1.05 MB
english, 2002
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