Detailed Kinetic Modeling Study of n-Pentanol Oxidation KA Heufer, SM Sarathy, HJ Curran, AC Davis, CK Westbrook, WJ Pitz Energy & Fuels 26 (11), 6678-6685, 2012 | 149 | 2012 |
A comprehensive experimental and modeling study of iso-pentanol combustion SM Sarathy, S Park, BW Weber, W Wang, PS Veloo, AC Davis, C Togbe, ... Combustion and flame 160 (12), 2712-2728, 2013 | 142 | 2013 |
Experiments and modeling of the autoignition of methylcyclohexane at high pressure BW Weber, WJ Pitz, M Mehl, EJ Silke, AC Davis, CJ Sung Combustion and Flame 161 (8), 1972-1983, 2014 | 119 | 2014 |
Computational study of the combustion and atmospheric decomposition of 2-methylfuran AC Davis, SM Sarathy The Journal of Physical Chemistry A 117 (33), 7670-7685, 2013 | 66 | 2013 |
Ab Initio Study of Hydrogen Migration across n-Alkyl Radicals AC Davis, JS Francisco The Journal of Physical Chemistry A 115 (14), 2966-2977, 2011 | 57 | 2011 |
Reactivity trends within alkoxy radical reactions responsible for chain branching AC Davis, JS Francisco Journal of the American Chemical Society 133 (45), 18208-18219, 2011 | 46 | 2011 |
A knowledge‐based potential highlights unique features of membrane α‐helical and β‐barrel protein insertion and folding D Hsieh, A Davis, V Nanda Protein Science 21 (1), 50-62, 2012 | 45 | 2012 |
Oxidation of 2-methylfuran and 2-methylfuran/n-heptane blends: An experimental and modeling study R Tripathi, U Burke, AK Ramalingam, C Lee, AC Davis, L Cai, H Selim, ... Combustion and Flame 196, 54-70, 2018 | 43 | 2018 |
Ab initio study of hydrogen migration in 1-alkylperoxy radicals AC Davis, JS Francisco The Journal of Physical Chemistry A 114 (43), 11492-11505, 2010 | 43 | 2010 |
High-pressure limit rate rules for α-H isomerization of hydroperoxyalkylperoxy radicals SY Mohamed, AC Davis, MJ Al Rashidi, SM Sarathy The Journal of Physical Chemistry A 122 (14), 3626-3639, 2018 | 37 | 2018 |
Primary steps in the reaction of OH radicals with peptide systems: perspective from a study of model amides HQ Doan, AC Davis, JS Francisco The Journal of Physical Chemistry A 114 (16), 5342-5357, 2010 | 30 | 2010 |
Ab initio study of key branching reactions in biodiesel and Fischer–Tropsch fuels AC Davis, JS Francisco Journal of the American Chemical Society 133 (47), 19110-19124, 2011 | 29 | 2011 |
Kinetics of the high-temperature combustion reactions of dibutylether using composite computational methods MJ Al Rashidi, AC Davis, SM Sarathy Proceedings of the Combustion Institute 35 (1), 385-392, 2015 | 27 | 2015 |
Modeling of microbial dynamics and geochemical changes in a metal bioprecipitation experiment H Prommer, ME Grassi, AC Davis, BM Patterson Environmental science & technology 41 (24), 8433-8438, 2007 | 22 | 2007 |
Effects of increasing acidity on metal (loid) bioprecipitation in groundwater: column studies AC Davis, BM Patterson, ME Grassi, BS Robertson, H Prommer, ... Environmental science & technology 41 (20), 7131-7137, 2007 | 22 | 2007 |
Hydrogen Migrations in Alkylcycloalkyl Radicals: Implications for Chain‐Branching Reactions in Fuels AC Davis, N Tangprasertchai, JS Francisco Chemistry–A European Journal 18 (36), 11296-11305, 2012 | 16 | 2012 |
Hydroxyalkoxy radicals: importance of intramolecular hydrogen bonding on chain branching reactions in the combustion and atmospheric decomposition of hydrocarbons AC Davis, JS Francisco The Journal of Physical Chemistry A 118 (46), 10982-11001, 2014 | 15 | 2014 |
Computational kinetics of hydroperoxybutylperoxy isomerizations and decompositions: a study of the effect of hydrogen bonding SY Mohamed, AC Davis, MJ Al Rashidi, SM Sarathy The Journal of Physical Chemistry A 122 (30), 6277-6291, 2018 | 9 | 2018 |
Ab initio study of chain branching reactions involving second generation products in hydrocarbon combustion mechanisms AC Davis, JS Francisco Physical Chemistry Chemical Physics 14 (4), 1343-1351, 2012 | 7 | 2012 |
Stereoselectivity in a series of 7‐alkylbicyclo [3.2. 0] hept‐2‐enes: Experimental and computational perspectives P Leber, K Kidder, D Viray, E Dietrich‐Peterson, Y Fang, A Davis Journal of Physical Organic Chemistry 31 (12), e3888, 2018 | 6 | 2018 |