| Unimolecular reactions KA Holbrook, MJ Pilling, SH Robertson (No Title), 1996 | 1167 | 1996 |
| COMPASS II: extended coverage for polymer and drug-like molecule databases H Sun, Z Jin, C Yang, RLC Akkermans, SH Robertson, NA Spenley, ... Journal of molecular modeling 22, 1-10, 2016 | 714 | 2016 |
| MESMER: an open-source master equation solver for multi-energy well reactions DR Glowacki, CH Liang, C Morley, MJ Pilling, SH Robertson The Journal of Physical Chemistry A 116 (38), 9545-9560, 2012 | 562 | 2012 |
| Monte Carlo methods in materials studio RLC Akkermans, NA Spenley, SH Robertson Molecular Simulation 39 (14-15), 1153-1164, 2013 | 333 | 2013 |
| Master equation models for chemical reactions of importance in combustion MJ Pilling, SH Robertson Annual review of physical chemistry 54 (1), 245-275, 2003 | 162 | 2003 |
| A theoretical analysis of the reaction between ethyl and molecular oxygen JA Miller, SJ Klippenstein, SH Robertson Proceedings of the Combustion Institute 28 (2), 1479-1486, 2000 | 145 | 2000 |
| VARIFLEX, version 1.00 SJ Klippenstein, AF Wagner, RC Dunbar, DM Wardlaw, SH Robertson Argonne National Laboratory, Argonne, IL, 1999 | 132 | 1999 |
| Temperature and pressure dependence of the multichannel rate coefficients for the CH3+ OH system R De Avillez Pereira, DL Baulch, MJ Pilling, SH Robertson, G Zeng The Journal of Physical Chemistry A 101 (50), 9681-9693, 1997 | 122 | 1997 |
| A theoretical analysis of the reaction between vinyl and acetylene: quantum chemistry and solution of the master equation JA Miller, SJ Klippenstein, SH Robertson The Journal of Physical Chemistry A 104 (32), 7525-7536, 2000 | 112 | 2000 |
| Fitting of pressure-dependent kinetic rate data by master equation/inverse Laplace transform analysis SH Robertson, MJ Pilling, DL Baulch, NJB Green The Journal of Physical Chemistry 99 (36), 13452-13460, 1995 | 111 | 1995 |
| Master equation methods for multiple well systems: application to the 1-, 2-pentyl system SH Robertson, MJ Pilling, LC Jitariu, IH Hillier Physical Chemistry Chemical Physics 9 (31), 4085-4097, 2007 | 110 | 2007 |
| Interception of excited vibrational quantum states by O2 in atmospheric association reactions DR Glowacki, J Lockhart, MA Blitz, SJ Klippenstein, MJ Pilling, ... Science 337 (6098), 1066-1069, 2012 | 103 | 2012 |
| Direct observation of equilibration in the system H+ C2H4⇄ C2H5: standard enthalpy of formation of the ethyl radical MA Hanning-Lee, NJB GREEN, MJ Pilling, SH Robertson Journal of physical chemistry (1952) 97 (4), 860-870, 1993 | 101 | 1993 |
| COMPASS III: Automated fitting workflows and extension to ionic liquids RLC Akkermans, NA Spenley, SH Robertson Molecular Simulation 47 (7), 540-551, 2021 | 100 | 2021 |
| VariFlex SJ Klippenstein, AF Wagner, RC Dunbar, DM Wardlaw, SH Robertson, ... Chemistry Division, Argonne National Laboratory, 1999 | 90* | 1999 |
| Direct studies on the decomposition of the tert-butoxy radical and its reaction with NO MJ Pilling, SH Robertson, PW Seakins Physical Chemistry Chemical Physics 1 (1), 73-80, 1999 | 90 | 1999 |
| Kinetics of the unimolecular decomposition of isopropyl: weak collision effects in helium, argon, and nitrogen PW Seakins, SH Robertson, MJ Pilling, IR Slagle, GW Gmurczyk, ... The Journal of Physical Chemistry 97 (17), 4450-4458, 1993 | 82 | 1993 |
| Combined experimental and master equation investigation of the multiwell reaction H+ SO2 MA Blitz, KJ Hughes, MJ Pilling, SH Robertson The Journal of Physical Chemistry A 110 (9), 2996-3009, 2006 | 79 | 2006 |
| Analysis of the Kinetics and Yields of OH Radical Production from the CH3OCH2 + O2 Reaction in the Temperature Range 195–650 K: An Experimental and … AJ Eskola, SA Carr, RJ Shannon, B Wang, MA Blitz, MJ Pilling, ... The Journal of Physical Chemistry A 118 (34), 6773-6788, 2014 | 65 | 2014 |
| Solvation of hydrogen halides on the surface of ice SH Robertson, DC Clary Faraday Discussions 100, 309-320, 1995 | 65 | 1995 |
