| Language-oriented rule-based reaction network generation and analysis: Description of RING S Rangarajan, A Bhan, P Daoutidis Computers & chemical engineering 45, 114-123, 2012 | 125 | 2012 |
| Overview of selective oxidation of ethylene to ethylene oxide by Ag catalysts T Pu, H Tian, ME Ford, S Rangarajan, IE Wachs ACS catalysis 9 (12), 10727-10750, 2019 | 121 | 2019 |
| On the Preferred Active Sites of Promoted MoS2 for Hydrodesulfurization with Minimal Organonitrogen Inhibition S Rangarajan, M Mavrikakis Acs Catalysis 7 (1), 501-509, 2017 | 95 | 2017 |
| Rule-based generation of thermochemical routes to biomass conversion S Rangarajan, A Bhan, P Daoutidis Industrial & Engineering Chemistry Research 49 (21), 10459-10470, 2010 | 92 | 2010 |
| Engineering Biomass Conversion Processes: A Systems Perspective. P Daoutidis, WA Marvin, S Rangarajan, AI Torres AIChE Journal 59 (1), 2013 | 84 | 2013 |
| DFT insights into the competitive adsorption of sulfur-and nitrogen-containing compounds and hydrocarbons on Co-promoted molybdenum sulfide catalysts S Rangarajan, M Mavrikakis Acs Catalysis 6 (5), 2904-2917, 2016 | 76 | 2016 |
| Kinetics and Thermochemistry of C4–C6 Olefin Cracking on H-ZSM-5 CJ Chen, S Rangarajan, IM Hill, A Bhan Acs Catalysis 4 (7), 2319-2327, 2014 | 71 | 2014 |
| Reaction mechanism of vapor-phase formic acid decomposition over platinum catalysts: DFT, reaction kinetics experiments, and microkinetic modeling S Bhandari, S Rangarajan, CT Maravelias, JA Dumesic, M Mavrikakis Acs Catalysis 10 (7), 4112-4126, 2020 | 70 | 2020 |
| Combining Computational Modeling with Reaction Kinetics Experiments for Elucidating the In Situ Nature of the Active Site in Catalysis S Bhandari, S Rangarajan, M Mavrikakis Accounts of Chemical Research 53 (9), 1893-1904, 2020 | 58 | 2020 |
| Site-dependent reactivity of MoS2 nanoparticles in hydrodesulfurization of thiophene N Salazar, S Rangarajan, J Rodríguez-Fernández, M Mavrikakis, ... Nature communications 11 (1), 4369, 2020 | 55 | 2020 |
| Sequential-optimization-based framework for robust modeling and design of heterogeneous catalytic systems S Rangarajan, CT Maravelias, M Mavrikakis The Journal of Physical Chemistry C 121 (46), 25847-25863, 2017 | 52 | 2017 |
| Language-oriented rule-based reaction network generation and analysis: Applications of RING S Rangarajan, A Bhan, P Daoutidis Computers & chemical engineering 46, 141-152, 2012 | 52 | 2012 |
| Adsorption of nitrogen‐and sulfur‐containing compounds on NiMoS for hydrotreating reactions: A DFT and vdW‐corrected study S Rangarajan, M Mavrikakis AIChE Journal 61 (12), 4036-4050, 2015 | 44 | 2015 |
| Process systems engineering for biorefineries: new research vistas P Daoutidis, A Kelloway, WA Marvin, S Rangarajan, AI Torres Current Opinion in Chemical Engineering 2 (4), 442-447, 2013 | 40 | 2013 |
| Language-oriented rule-based reaction network generation and analysis: Algorithms of RING S Rangarajan, T Kaminski, E Van Wyk, A Bhan, P Daoutidis Computers & Chemical Engineering 64, 124-137, 2014 | 38 | 2014 |
| Automated generation and optimal selection of biofuel-gasoline blends and their synthesis routes WA Marvin, S Rangarajan, P Daoutidis Energy & Fuels 27 (6), 3585-3594, 2013 | 38 | 2013 |
| Adsorption of small alkanes on ZSM-5 zeolites: influence of Brønsted sites YH Yeh, RJ Gorte, S Rangarajan, M Mavrikakis The Journal of Physical Chemistry C 120 (22), 12132-12138, 2016 | 37 | 2016 |
| An Adsorption Study of CH4 on ZSM-5, MOR, and ZSM-12 Zeolites Y Zhang, JY Yu, YH Yeh, RJ Gorte, S Rangarajan, M Mavrikakis The Journal of Physical Chemistry C 119 (52), 28970-28978, 2015 | 37 | 2015 |
| Automated identification of energetically feasible mechanisms of complex reaction networks in heterogeneous catalysis: application to glycerol conversion on transition metals S Rangarajan, RRO Brydon, A Bhan, P Daoutidis Green Chemistry 16 (2), 813-823, 2014 | 36 | 2014 |
| Identification and analysis of synthesis routes in complex catalytic reaction networks for biomass upgrading S Rangarajan, A Bhan, P Daoutidis Applied Catalysis B: Environmental 145, 149-160, 2014 | 28 | 2014 |
