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20032003
New, computer-discovered pathways for methane and ethane pyrolysis
Preprints of the ACS Division of Fuel Chemistry -
2003
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20032003
Reduced Models for Adaptive Chemistry Simulation of Reacting Flows
Computational Fluid and Solid Mechanics: Proceedings of the Second MIT Conference on Computational Fluid and Solid Mechanics, ed -
20032003
Mechanism Generation with Integrated Pressure-Dependence: A New Model for Methane Pyrolysis
Journal of Physical Chemistry A1078552-8565 -
20032003
Oxygenate, Oxyalkyl, and Alkoxycarbonyl Thermochemistry and Rates for Hydrogen Abstraction from Oxygenates
Physical Chemistry Chemical Physics53402-3417 -
20032003
Prediction of the Knock Limit and the Viable Operating Range for a PRF-fueled Homogeneous Charge Compression Ignition (HCCI) engine
Homogeneous Charge Compression Ignition (HCCI) CombustionSP-1742 -
2002
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20022002
Valid Parameter Range Analyses for Chemical Reaction Kinetic Models
Chemical Engineering Science574475 -
20022002
Reaction Rate Prediction via Group Additivity Part 3: Effect of Substituents with CH2 as the Mediator
Journal of Physical Chemistry A1065474-5489 -
20022002
JThermodynamic Properties of Ketenes: Group Additivity Values from Quantum Chemical Calculations
Journal of Physical Chemistry A1067937-7949 -
20022002
Water-based Magnetic Fluids as Extractants for Synthetic Organic Compounds
Industrial & Engineering Chemistry Research414739-4749 -
2002
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20022002
Missing thermochemical groups for large unsaturated hydrocarbons: Contrasting predictions of G2 and CBS-Q
Journal of Physical Chemistry A10611141-11149 -
20022002
Building and screening pressure-dependent reactions for large, gas-phase chemical mechanisms
Preprints of the ACS Division of Petroleum Chemistry -
20012001
Detailed Kinetic Study of the Growth of Small Polycyclic Aromatic Hydrocarbons. I. 1-Naphthyl + Ethyne
Journal of Physical Chemistry A1051561-73 -
20012001
Computer-Construction of Detailed Models for Gas-Phase Reactors
Industrial & Engineering Chemistry Research405362-5370 -
20012001
Rate-Based Screening of Pressure-Dependent Reaction Networks
Computer Physics Communications138237-249 -
20012001
Split-Operator Methods for Computing Steady-State Reacting Flow-fields
Proceedings of the 15th AIAA Computational Fluid Dynamics Conference11-14 -
20012001
Review and Assessment of Fuel Effects and Research Needs in Clean Diesel Technology
Proceedings of the ASME Internal Combustion Engine Division Spring Technical Conference23-37 -
20012001
Adaptive Chemistry
Computational Fluid and Solid Mechanics: Proceedings of the First MIT Conference on Computational Fluid and Solid Mechanics12-15 -
20012001
Jr. “Reaction Rate Prediction via Group Additivity, Part 1: H Abstraction from Alkanes by H and CH3”
Journal of Physical Chemistry A1056910-6925 -
20012001
Reaction Rate Prediction via Group Additivity, Part 2: H Abstraction from Alkenes, Alkynes, Alcohols and Acids by H atoms
Journal of Physical Chemistry A1058969-8984 -
2000
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20002000
Analysis of an Elementary Reaction Mechanism for Benzene Oxidation in Supercritical Water
Proceedings of the Combustion Institute1529-36 -
20002000
Computer-Aided Construction of Combustion Chemistry Models
Preprints of the ACS Division of Fuel Chemistry45270-272
Fundamental and Applied Chemical Kinetics