Chemical Reaction Molecular Dynamics Simulation and the Energy-Transfer Mechanism in the Proton-Transfer Reaction of Formamidine in Aqueous Solution
- 1 December 1994
- journal article
- research article
- Published by American Chemical Society (ACS) in The Journal of Physical Chemistry
- Vol. 98 (48) , 12506-12515
- https://doi.org/10.1021/j100099a011
Abstract
No abstract availableKeywords
This publication has 4 references indexed in Scilit:
- Solvent effects on dynamics of overtone-induced dissociationThe Journal of Physical Chemistry, 1993
- Extended transition-state theory and constant-energy chemical-reaction molecular-dynamics method for liquid-phase chemical reactionsThe Journal of Chemical Physics, 1992
- Abinitio calculations and the chemical reaction molecular dynamics simulationCanadian Journal of Chemistry, 1992
- Exact Defect Calculations in Model SubstancesPublished by Elsevier ,1975