Found 332 results
Ab initio Screening of Metal Sorbents for Elemental Mercury Capture in Syngas Streams. Chemical Engineering Science. 65:3025-3033.. 2010.
Accurate Reaction Networks for Alternative Fuels: Butanol Isomers. Industrial & Engineering Chemistry Research. 49:10399-10420.. 2010.
Dynamic Spatial and Temporal Allocation of Reduced Chemical Kinetics Models in Combustion Computational Fluid Dynamics Simulations. 46th AIAA/ASME/SAE/ASEE Joint Propulsion Conference. :6827.. 2010.
Intramolecular Hydrogen Migration in Alkylperoxy and Hydroperoxy-alkylperoxy Radicals: Accurate Treatment of Hindered Rotors. Journal of Physical Chemistry A. 114:5689-5701.. 2010.
Modeling of 1-hexadiene, 2,4-hexadiene and 1,4-hexadiene doped methane flames: Flame modeling, Benzene and Styrene formation. Combustion & Flame. 157:1331-1345.. 2010.
Predicting Solvation Energies for Kinetic Modeling. Annual Reports on the Progress of Chemistry Section C. 106:1-49.. 2010.
The Underlying Physics and Chemistry Behind Fuel Sensitivity. SAE International Journal of Fuels and Lubricants. 3:256-265.. 2010.
Updating Our Understanding of JP-10 Decomposition Chemistry: A Detailed JP-10 Combustion Mechanism Constructed Using RMG an Automatic Reaction Mechanism Generator. 46th AIAA/ASME/SAE/ASEE Joint Propulsion Conference. :2010-6825.. 2010.
21st-Century Kinetics: Quantitative Predictions from First Principles. Proceedings of the 8th World Congress of Chemical Engineering.. 2009.
Computational Investigation of Thermochemistry and Kinetics of Steam Methane Reforming on Ni(111) under Realistic Conditions. Journal of Physical Chemistry C. 113:4894-4908.. 2009.
Computed rate coefficients and product yields for C5H5 + CH3 = products. Journal of Physical Chemistry A. 113:8871-8882.. 2009.
A Detailed Kinetic Model for Combustion Synthesis of Titania from TiCl4. Combustion and Flame. 156:1764-1770.. 2009.
Formation of Styrene from propargyl and cyclopentadienyl. Proceedings of the 6th US National Combustion Meeting.. 2009.
Pressure and Temperature Dependence of the Reaction of Vinyl Radical with Alkenes II: Measured Rates and Predicted Product Distributions for Vinyl + Propene. Proceedings of the Combustion Institute. :139-148.. 2009.
Pressure and Temperature Dependence of the Reaction of Vinyl Radical with Alkenes III: Measured Rates and Predicted Product Distributions for Vinyl + Butene. Journal of Physical Chemistry A. 113:13357-13371.. 2009.
Temperature-Dependent Kinetics of the Vinyl Radical (C2H3) Self-Reaction. Journal of Physical Chemistry A. 113:1278-1286.. 2009.
Using adaptive proper orthogonal decomposition to solve the reaction-diffusion equation. Applied Numerical Mathematics. 59:272-279.. 2009.
Building and Solving Accurate Combustion Chemistry Simulations. Journal of the Combustion Society of Japan. 50:19-28.. 2008.
Co-oxidation of ammonia and ethanol in supercritical water, part 2: Modeling demonstrates the importance of H2NNOx. International Journal of Chemical Kinetics. 40:653-662.. 2008.
Detailed Chemical Kinetic Simulations of HCCI Engine Transients. International Journal of Engine Research. 9:149-164.. 2008.
Experimental study of catalyst nanoparticle and single walled carbon nanotube formation in a controlled premixed combustion. Journal of Materials Chemistry. 18:1561-1569.. 2008.
Modelling Gas-Phase Synthesis of Single-Walled Carbon Nanotubes on Iron Catalyst Particles. Carbon. 46:422-433.. 2008.
Optimal Automatic Reaction and Species Elimination in Kinetic Mechanisms. Combustion & Flame. 155:118-132.. 2008.
Predicted Reaction Rates of HxNyOz Intermediates in the Oxidation of Hydroxylamine by Aqueous Nitric Acid. Journal of Physical Chemistry A. 112:7577-7593.. 2008.
Primary Reference Fuel Behavior in a HCCI Engine Near the Low-Load Limit. SAE. 1667:2008-01.. 2008.