Found 10 results
Filters: Author is Richard H. West [Clear All Filters]
Reaction Mechanism Generator v3.0: Advances in Automatic Mechanism Generation. Journal of Chemical Information and Modeling. 61:2686–2696.. 2021.
On-the-Fly Pruning for Rate-Based Reaction Mechanism Generation. Computers and Chemical Engineering. 100:1-8.. 2017.
Reaction Mechanism Generator: Automatic construction of chemical kinetic mechanisms. Computer Physics Communications. 203:212–225.. 2016.
An Extensible Framework for Capturing Solvent Effects in Computer Generated Kinetic Models. Journal of Physical Chemistry B. 117:2955-2970.. 2013.
Kinetic Modeling of Methyl Formate Oxidation. 7th US National Technical Meeting of the Combustion Institute, paper 1A06.. 2011.
Predicting Solvation Energies for Kinetic Modeling. Annual Reports on the Progress of Chemistry Section C. 106:1-49.. 2010.
21st-Century Kinetics: Quantitative Predictions from First Principles. Proceedings of the 8th World Congress of Chemical Engineering.. 2009.
A Detailed Kinetic Model for Combustion Synthesis of Titania from TiCl4. Combustion and Flame. 156:1764-1770.. 2009.
First Principles Thermochemistry for production of TiO2 from TiCl4. Journal of Physical Chemistry A. 111:3560-3565.. 2007.
Towards a Comprehensive Model of the Synthesis of TiO2 Particles from TiCl4. Industrial & Engineering Chemistry Research. 46:6147-6156.. 2007.