Reaction Networks and Mechanisms: Discovery and Application in Combustion
Abstract
1) Advance fundamental theory that can be used for generating and modeling complex chemical reaction networks using methods of ab initio quantum chemistry, molecular dynamics, and reaction rate theories at the onset of an investigation. 2) Develop mathematical and computational methods for rational generation and utilization of reaction network models with improved predictivity and reduced dimensionality; 3) Generate computationally adaptable modeling tools for combustion chemistry.
Document Details
- Document Type
- DoD Grant Award
- Publication Date
- Mar 23, 2016
- Source ID
- FA95501610051
Entities
People
- Hai Wang
Organizations
- Air Force Office of Scientific Research
- Stanford University
- United States Air Force