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Israel Journal of Chemistry

Volumn 42, Issue 2-3, 2002, Pages 225-236

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

(3) Navrotskaya, Irina a Shi, Qiang a Geva, Eitan a

a UNIVERSITY OF MICHIGAN (United States)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO CALCULATION; ARTICLE; MATHEMATICAL ANALYSIS; QUANTUM MECHANICS; REACTION ANALYSIS; SIMULATION;

EID: 0038103649 PISSN: 00212148 EISSN: None Source Type: Journal
DOI: 10.1560/46PR-4LGF-EHNY-NDHL Document Type: Article

Times cited : (7)

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