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Direct Monte Carlo simulation of chemical reaction systems: Simple bimolecular reactions

✍ Scribed by Piersall, Shannon D.; Anderson, James B.

Book ID
121090801
Publisher
American Institute of Physics
Year
1991
Tongue
English
Weight
956 KB
Volume
95
Category
Article
ISSN
0021-9606

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πŸ“œ SIMILAR VOLUMES

Direct Monte Carlo simulation of chemica
Direct Monte Carlo simulation of chemical reaction systems: a Lindemannβ€”Christiansen unimolecular reaction
✍ Shannon Dunn Piersall; James B. Anderson πŸ“‚ Article πŸ“… 1992 πŸ› Elsevier Science 🌐 English βš– 398 KB

We report a direct Monte Carlo simulation of a Lindemann-Christiansen unimolecular reaction system. The simulation is carried out at the molecular level and includes energy transfer among reactants and products as well as the reaction steps. The usual differential equations of chemical kinetics are