Insights into the interplay of Lewis and Brønsted acid catalysts in glucose and fructose conversion to 5-(hydroxymethyl) furfural and levulinic acid in aqueous media V Choudhary, SH Mushrif, C Ho, A Anderko, V Nikolakis, NS Marinkovic, ... Journal of the American Chemical Society 135 (10), 3997-4006, 2013 | 721 | 2013 |
Revealing pyrolysis chemistry for biofuels production: Conversion of cellulose to furans and small oxygenates MS Mettler, SH Mushrif, AD Paulsen, AD Javadekar, DG Vlachos, ... Energy & Environmental Science 5 (1), 5414-5424, 2012 | 353 | 2012 |
Understanding solvent effects in the selective conversion of fructose to 5-hydroxymethyl-furfural: a molecular dynamics investigation SH Mushrif, S Caratzoulas, DG Vlachos Physical Chemistry Chemical Physics 14 (8), 2637-2644, 2012 | 179 | 2012 |
Origins of complex solvent effects on chemical reactivity and computational tools to investigate them: a review JJ Varghese, SH Mushrif Reaction Chemistry & Engineering 4 (2), 165-206, 2019 | 153 | 2019 |
Fast pyrolysis of cellulose, hemicellulose, and lignin: effect of operating temperature on bio-oil yield and composition and insights into the intrinsic pyrolysis chemistry KB Ansari, JS Arora, JW Chew, PJ Dauenhauer, SH Mushrif Industrial & Engineering Chemistry Research 58 (35), 15838-15852, 2019 | 138 | 2019 |
Synergistic application of XPS and DFT to investigate metal oxide surface catalysis QT Trinh, K Bhola, PN Amaniampong, F Jerome, SH Mushrif The Journal of Physical Chemistry C 122 (39), 22397-22406, 2018 | 124 | 2018 |
Insights into the solvation of glucose in water, dimethyl sulfoxide (DMSO), tetrahydrofuran (THF) and N, N-dimethylformamide (DMF) and its possible implications on the … V Vasudevan, SH Mushrif RSC Advances 5 (27), 20756-20763, 2015 | 124 | 2015 |
Insights into the solvation of glucose in water, dimethyl sulfoxide (DMSO), tetrahydrofuran (THF) and N, N-dimethylformamide (DMF) and its possible implications on the … V Vasudevan, SH Mushrif RSC Advances 5 (27), 20756-20763, 2015 | 124 | 2015 |
Unraveling the mechanism of the oxidation of glycerol to dicarboxylic acids over a sonochemically synthesized copper oxide catalyst PN Amaniampong, QT Trinh, JJ Varghese, R Behling, S Valange, ... Green Chemistry 20 (12), 2730-2741, 2018 | 99 | 2018 |
Biomass Oxidation: Formyl C H Bond Activation by the Surface Lattice Oxygen of Regenerative CuO Nanoleaves PN Amaniampong, QT Trinh, B Wang, A Borgna, Y Yang, SH Mushrif Angewandte Chemie International Edition 54 (31), 8928-8933, 2015 | 89 | 2015 |
Insights into the Cr (III) catalyzed isomerization mechanism of glucose to fructose in the presence of water using ab initio molecular dynamics SH Mushrif, JJ Varghese, DG Vlachos Physical Chemistry Chemical Physics 16 (36), 19564-19572, 2014 | 68 | 2014 |
Insights into the synergistic role of metal–lattice oxygen site pairs in four-centered C–H bond activation of methane: the case of CuO JJ Varghese, QT Trinh, SH Mushrif Catalysis Science & Technology 6 (11), 3984-3996, 2016 | 62 | 2016 |
Hydrogenation of Carbon Monoxide into Formaldehyde in Liquid Media AM Bahmanpour, A Hoadley, SH Mushrif, A Tanksale ACS Sustainable Chemistry & Engineering 4 (7), 3970-3977, 2016 | 57 | 2016 |
Fructose–water–dimethylsulfoxide interactions by vibrational spectroscopy and molecular dynamics simulations V Nikolakis, SH Mushrif, B Herbert, KS Booksh, DG Vlachos The Journal of Physical Chemistry B 116 (36), 11274-11283, 2012 | 57 | 2012 |
Understanding Acidity of Molten Salt Hydrate Media for Cellulose Hydrolysis by Combining Kinetic Studies, Electrolyte Solution Modeling, Molecular Dynamics Simulations, and 13C … N Rodriguez Quiroz, AMD Padmanathan, SH Mushrif, DG Vlachos ACS Catalysis 9 (11), 10551-10561, 2019 | 54 | 2019 |
Sub-Surface Boron-Doped Copper for Methane Activation and Coupling: First-Principles Investigation of the Structure, Activity, and Selectivity of the Catalyst QT Trinh, A Banerjee, Y Yang, SH Mushrif The Journal of Physical Chemistry C 121 (2), 1099-1112, 2017 | 54 | 2017 |
Adsorption and Reactivity of Cellulosic Aldoses on Transition Metals QT Trinh, BK Chethana, SH Mushrif The Journal of Physical Chemistry C, 2015 | 53 | 2015 |
Insights into the C–H Bond Activation on NiO Surfaces: The Role of Nickel and Oxygen Vacancies and of Low Valent Dopants on the Reactivity and Energetics JJ Varghese, SH Mushrif The Journal of Physical Chemistry C 121 (33), 17969-17981, 2017 | 52 | 2017 |
Mechanistic insights into the catalytic elimination of tar and the promotional effect of boron on it: first-principles study using toluene as a model compound QT Trinh, AV Nguyen, DC Huynh, TH Pham, SH Mushrif Catalysis Science & Technology 6 (15), 5871-5883, 2016 | 52 | 2016 |
Influence of Alkali and Alkaline-Earth Metals on the Cleavage of Glycosidic Bond in Biomass Pyrolysis: A DFT Study Using Cellobiose as a Model Compound JS Arora, JW Chew, SH Mushrif The Journal of Physical Chemistry A 122 (38), 7646-7658, 2018 | 51 | 2018 |