Found 9 results
Filters: Author is Green, William H.  [Clear All Filters]
Dana AGrinberg, Johnson MS, Allen JW, Sharma S, Raman S, Liu M, Gao CW, Grambow CA, Goldman MJ, Ranasinghe DS et al..  2023.  Automated reaction kinetics and network exploration (Arkane): A statistical mechanics, thermodynamics, transition state theory, and master equation software. International Journal of Chemical Kinetics. 55(6):300-323.
Dong X, Pio G, Arafin F, Laich A, Baker J, Ninnemann E, Vasu SS, Green WH.  2023.  Butyl Acetate Pyrolysis and Combustion Chemistry: Mechanism Generation and Shock Tube Experiments. The Journal of Physical Chemistry A. 127(14):3231-3245.
Heid E, McGill CJ, Vermeire FH, Green WH.  2023.  Characterizing Uncertainty in Machine Learning for Chemistry. Journal of Chemical Information and Modeling. 63(13):4012-4029.
Chung Y, Green WH.  2023.  Computing Kinetic Solvent Effects and Liquid Phase Rate Constants Using Quantum Chemistry and COSMO-RS Methods. The Journal of Physical Chemistry A. 127(27):5637-5651.
Pang H-W, Forsuelo M, Dong X, Hawtof RE, Ranasinghe DS, Green WH.  2023.  Detailed Multiphase Chemical Kinetic Model for Polymer Fouling in a Distillation Column. Industrial & Engineering Chemistry ResearchIndustrial & Engineering Chemistry Research.
Biswas S, Sader KMoreno, Green WH.  2023.  Perspective on Decarbonizing Long-Haul Trucks Using Onboard Dehydrogenation of Liquid Organic Hydrogen Carriers. Energy & Fuels.
Biswas S, Chung Y, Ramirez J, Wu H, Green WH.  2023.  Predicting Critical Properties and Acentric Factors of Fluids Using Multitask Machine Learning. Journal of Chemical Information and Modeling. 63(15):4574-4588.
Liang J, He R, Nagaraja SS, A. Mohamed AEl-Sabor, Lu H, Almarzooq YM, Dong X, Mathieu O, Green WH, Petersen EL et al..  2023.  A wide range experimental and kinetic modeling study of the oxidation of 2,3-dimethyl-2-butene: Part 1. Combustion and Flame. 251:112731.