Publications

Found 262 results
2016
Class CA, Liu M, Vandeputte AG, Green WH.  2016.  Automatic Mechanism Generation for Pyrolysis of Di-tert-Butyl Sulfide. Physical Chemistry Chemical Physics. 18:21651.
Dames EE, Rosen AS, Weber BW, Gao CW, Sung C-J, Green WH.  2016.  A detailed combined experimental and theoretical study on dimethyl ether / propane blended oxidation. Combustion & Flame. 168:310-330.
Dames EE, Green WH.  2016.  The effect of alcohol and carbonyl functional groups on the competition between unimolecular decomposition and isomerization in C4 and C5 alkoxy radicals. International Journal of Chemical Kinetics. 48:544-555.
Lim EG, Dames EE, Acocella AJ, Needham TR, Arce A, Cohn D, Bromberg L, Cheng WK, Green WH.  2016.  The Engine Reformer: Syngas Production in an Engine for Compact Gas-to-Liquids Synthesis. Canadian Journal of Chemical Engineering. 94:623-635.
Carr AG, Shi X, Domene C, Leung AK, Green WH.  2016.  Methanol Formation from the Treatment of Glycerol in Supercritical Water and with Ethylsulfide. Journal of Supercritical Fluids. 117:80-88.
Trevisanut C, Jazayeri SM, Bonkane S, Neagoe C, Mohamadalizadeh A, Boffito DC, Bianchi CL, Pirola C, Frost L, Lerou J et al..  2016.  Micro-Syngas Technology options for GtL. Canadian Journal of Chemical Engineering. 94:613-622.
Gao CW, Allen JW, Green WH, West RH.  2016.  Reaction Mechanism Generator: Automatic construction of chemical kinetic mechanisms. Computer Physics Communications. 203:212–225.
Elsamra RIE, Buras ZJ, Jalan A, Middaugh JE, Green WH.  2016.  Temperature and Pressure Dependent Kinetics of CH2OO + CH3COCH3 and CH2OO + CH3CHO: Direct Measurements and Theoretical Analysis. International Journal of Chemical Kinetics. 48:474-488.
2015
Suleimanov YV, Green WH.  2015.  Automated Discovery of Elementary Chemical Reaction Steps Using Freezing String and Berny Optimization Methods�. Journal of Chemical Theory & Computation. 11:4248.
Mevel R, Chatelain K, Catoire L, Green WH, Shepherd JE.  2015.  Chemical Kinetics of Acetaldehyde Pyrolysis and Oxidation. 9th U.S National Combustion Meeting, paper. 114
Newman SG, Lee K, Cai J, Yang L, Green WH, Jensen KF.  2015.  Continuous Thermal Oxidation of Alkenes with Nitrous Oxide in a Packed Bed Reactor. Industrial & Engineering Chemistry Research. 54:4166.
Fridlyand A, S. Goldsborough S, Brezinsky K, Merchant SS, Green WH.  2015.  Influence of Double Bond Position on the Oxidation of Decene Isomers. Proceedings of the Combustion Institute 35. :333-340.
Gao CW, Vandeputte AG, Yee NW, Green WH, Bonomi RE, Magoon GR, Wong H-W, Oluwole OO, Lewis DK, Vandewiele NM et al..  2015.  JP-10 combustion studied with shock tube experiments and modeled with automatic reaction mechanism generation. Combustion and Flame. 162:3115–3129.
Class CA, Aguilera-Iparraguirre J, Green WH.  2015.  A kinetic and thermochemical database for organic sulfur and oxygen compounds. Phys. Chem. Chem. Phys.. 17:13625–13639.
Vandewiele NM, Magoon GR, Van Geem KM, Reyniers M-F, Green WH, Marin GB.  2015.  Kinetic Modeling of Jet-Propellant 10 Pyrolysis. Energy & Fuels. 29:413-427.
Buras ZJ, Dames EE, Merchant SS, Liu G, Elsamra RMI, Green WH.  2015.  Kinetics and Products of Vinyl + 1,3-Butadiene, a Potential Route to Benzene. The journal of physical chemistry. A. 119:7325–38.
Wright MMba, Seifkar N, Green WH, Roman-Leshkov Y.  2015.  Natural Gas and Cellulosic Biomass: A Clean Fuel Combination? Determining the Natural Gas Blending Wall in Biofuel Production Environmental Science & Technology. 49:8183.
Shetty M, Murugappan K, Prasomsri T, Green WH, Roman-Leshkov Y.  2015.  Reactivity and stability investigation of supported molybdenum oxide catalysts for the hydrodeoxygenation (HDO) of m-cresol. Journal of Catalysis. 331:86-97.
Buras ZJ, Dames EE, Merchant SS, Liu G.  2015.  Rehab MI Elsamra and William H Green, Kinetics and Products of Vinyl + 1,3-Butadienea Potential Route to Benzene. Journal of Physical Chemistry A. 119:7325.
Van de Vijver R, Vandewiele NM, Vandeputte AG, Van Geem KM, Reyniers M-F, Green WH, Marin GB.  2015.  Rule-Based Ab initio kinetic model for alkyl sulfide pyrolysis. Chemical Engineering Journal. 278:385-393.
Carr AG, Class CA, Lai LTC, Kida Y, Monrose TE, Green WH.  2015.  Supercritical Water Treatment of Crude Oil and Hexylbenzene: An Experimental and Mechanistic Study on Alkylbenzene Decomposition. Energy & Fuels. 29:5290.
Merchant SS, C. Goldsmith F, Vandeputte AG, Burke MP, Klippenstein SJ, Green WH.  2015.  Understanding low-temperature first-stage ignition delay: Propane. Combustion & Flame. 162:3658-3673.
Timko MT, Ghoniem AF, Green WH.  2015.  Upgrading and Desulfurization of Heavy Oils by Supercritical Water. Journal of Supercritical Fluids. 96:114-123.

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