Reactive symbol sequences for a model of hydrogen combustion
Abstract
A chemically-informed symbolic dynamics is used as a coarse-grained representation of classical molecular dynamics with a reactive force field, and applied to the sequences of chemical species for a model of hydrogen combustion.
Document Details
- Document Type
- Pub Defense Publication
- Publication Date
- Jan 01, 2016
- Source ID
- 10.1039/c5cp05125h
Entities
People
- Jason R Green
- Mohammad Alaghemandi
Organizations
- Army Research Office
- United States Army
- University of Massachusetts Boston
- Yusuf Hamied Department of Chemistry