| Coherent switching with decay of mixing: an improved treatment of electronic coherence for non-Born–Oppenheimer trajectories C Zhu, S Nangia, AW Jasper, DG Truhlar The Journal of chemical physics 121 (16), 7658-7670, 2004 | 389 | 2004 |
| Kinetics of the reaction of methyl radical with hydroxyl radical and methanol decomposition AW Jasper, SJ Klippenstein, LB Harding, B Ruscic The Journal of Physical Chemistry A 111 (19), 3932-3950, 2007 | 252 | 2007 |
| Non-born− oppenheimer molecular dynamics AW Jasper, S Nangia, C Zhu, DG Truhlar Accounts of chemical research 39 (2), 101-108, 2006 | 250 | 2006 |
| Introductory lecture: Nonadiabatic effects in chemical dynamics AW Jasper, C Zhu, S Nangia, DG Truhlar Faraday Discussions 127, 1-22, 2004 | 241 | 2004 |
| Lennard–Jones parameters for combustion and chemical kinetics modeling from full-dimensional intermolecular potentials AW Jasper, JA Miller Combustion and flame 161 (1), 101-110, 2014 | 209 | 2014 |
| Fewest-switches with time uncertainty: A modified trajectory surface-hopping algorithm with better accuracy for classically forbidden electronic transitions AW Jasper, SN Stechmann, DG Truhlar The Journal of chemical physics 116 (13), 5424-5431, 2002 | 208 | 2002 |
| Non-Born–Oppenheimer trajectories with self-consistent decay of mixing C Zhu, AW Jasper, DG Truhlar The Journal of chemical physics 120 (12), 5543-5557, 2004 | 192 | 2004 |
| Ab initio methods for reactive potential surfaces LB Harding, SJ Klippenstein, AW Jasper Physical Chemistry Chemical Physics 9 (31), 4055-4070, 2007 | 189 | 2007 |
| The reaction between propene and hydroxyl J Zádor, AW Jasper, JA Miller Physical Chemistry Chemical Physics 11 (46), 11040-11053, 2009 | 179 | 2009 |
| Predictive a priori pressure-dependent kinetics AW Jasper, KM Pelzer, JA Miller, E Kamarchik, LB Harding, ... Science 346 (6214), 1212-1215, 2014 | 175 | 2014 |
| Detection and Identification of the Keto-Hydroperoxide (HOOCH2OCHO) and Other Intermediates during Low-Temperature Oxidation of Dimethyl Ether K Moshammer, AW Jasper, DM Popolan-Vaida, A Lucassen, P Diévart, ... The Journal of Physical Chemistry A 119 (28), 7361-7374, 2015 | 172 | 2015 |
| Non-Born-Oppenheimer Liouville-von Neumann dynamics. Evolution of a subsystem controlled by linear and population-driven decay of mixing with decoherent and coherent switching C Zhu, AW Jasper, DG Truhlar Journal of chemical theory and computation 1 (4), 527-540, 2005 | 165 | 2005 |
| Temperature-and pressure-dependent rate coefficients for the HACA pathways from benzene to naphthalene AM Mebel, Y Georgievskii, AW Jasper, SJ Klippenstein Proceedings of the Combustion Institute 36 (1), 919-926, 2017 | 158 | 2017 |
| Theoretical Unimolecular Kinetics for CH4 + M ⇄ CH3 + H + M in Eight Baths, M = He, Ne, Ar, Kr, H2, N2, CO, and CH4 AW Jasper, JA Miller The Journal of Physical Chemistry A 115 (24), 6438-6455, 2011 | 156 | 2011 |
| Improved treatment of momentum at classically forbidden electronic transitions in trajectory surface hopping calculations AW Jasper, DG Truhlar Chemical physics letters 369 (1-2), 60-67, 2003 | 150 | 2003 |
| Combustion chemistry in the twenty-first century: Developing theory-informed chemical kinetics models JA Miller, R Sivaramakrishnan, Y Tao, CF Goldsmith, MP Burke, ... Progress in Energy and Combustion Science 83, 100886, 2021 | 149 | 2021 |
| Roaming radicals in the thermal decomposition of dimethyl ether: Experiment and theory R Sivaramakrishnan, JV Michael, AF Wagner, R Dawes, AW Jasper, ... Combustion and Flame 158 (4), 618-632, 2011 | 125 | 2011 |
| Hydrogen-assisted isomerizations of fulvene to benzene and of larger cyclic aromatic hydrocarbons AW Jasper, N Hansen Proceedings of the Combustion Institute 34 (1), 279-287, 2013 | 122 | 2013 |
| “Third-Body” collision efficiencies for combustion modeling: Hydrocarbons in atomic and diatomic baths AW Jasper, CM Oana, JA Miller Proceedings of the combustion Institute 35 (1), 197-204, 2015 | 120 | 2015 |
| Theoretical rate coefficients for the reaction of methyl radical with hydroperoxyl radical and for methylhydroperoxide decomposition AW Jasper, SJ Klippenstein, LB Harding Proceedings of the combustion institute 32 (1), 279-286, 2009 | 120 | 2009 |
