Quantum-mechanical reaction rate constants from centroid...

Quantum-mechanical reaction rate constants from centroid molecular dynamics simulations: Barrier crossing in an asymmetrical double-well

Irina Navrotskaya, Qiang Shi, Eitan Geva
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Volume:
42
Year:
2002
Language:
english
DOI:
10.1560/46pr-4lgf-ehny-ndhl
File:
PDF, 1.93 MB
english, 2002
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