The cobalt–methyl bond dissociation in methylcobalamin: new benchmark analysis based on density functional theory and completely renormalized coupled-cluster calculations PM Kozlowski, M Kumar, P Piecuch, W Li, NP Bauman, JA Hansen, ... Journal of Chemical Theory and Computation 8 (6), 1870-1894, 2012 | 109 | 2012 |
Insight into chemistry on cloud/aerosol water surfaces J Zhong, M Kumar, JS Francisco, XC Zeng Accounts of chemical research 51 (5), 1229-1237, 2018 | 108 | 2018 |
Near-barrierless ammonium bisulfate formation via a loop-structure promoted proton-transfer mechanism on the surface of water L Li, M Kumar, C Zhu, J Zhong, JS Francisco, XC Zeng Journal of the American chemical society 138 (6), 1816-1819, 2016 | 103 | 2016 |
New mechanistic pathways for Criegee–water chemistry at the air/water interface C Zhu, M Kumar, J Zhong, L Li, JS Francisco, XC Zeng Journal of the American Chemical Society 138 (35), 11164-11169, 2016 | 98 | 2016 |
Determinants of activity at human Toll-like receptors 7 and 8: quantitative structure–activity relationship (QSAR) of diverse heterocyclic scaffolds E Yoo, DB Salunke, D Sil, X Guo, ACD Salyer, AR Hermanson, M Kumar, ... Journal of medicinal chemistry 57 (19), 7955-7970, 2014 | 82 | 2014 |
Role of double hydrogen atom transfer reactions in atmospheric chemistry M Kumar, A Sinha, JS Francisco Accounts of Chemical Research 49 (5), 877-883, 2016 | 80 | 2016 |
Atmospheric spectroscopy and photochemistry at environmental water interfaces J Zhong, M Kumar, JM Anglada, MTC Martins-Costa, MF Ruiz-Lòpez, ... Annual review of physical chemistry 70 (1), 45-69, 2019 | 66 | 2019 |
Surprising stability of larger Criegee intermediates on aqueous interfaces J Zhong, M Kumar, CQ Zhu, JS Francisco, XC Zeng Angewandte Chemie International Edition 56 (27), 7740-7744, 2017 | 65 | 2017 |
Barrierless tautomerization of Criegee intermediates via acid catalysis M Kumar, DH Busch, B Subramaniam, WH Thompson Physical Chemistry Chemical Physics 16 (42), 22968-22973, 2014 | 61 | 2014 |
Nitric acid–amine chemistry in the gas phase and at the air–water interface M Kumar, H Li, X Zhang, XC Zeng, JS Francisco Journal of the American Chemical Society 140 (20), 6456-6466, 2018 | 60 | 2018 |
Ligand effects on the regioselectivity of rhodium-catalyzed hydroformylation: Density functional calculations illuminate the role of long-range noncovalent interactions M Kumar, RV Chaudhari, B Subramaniam, TA Jackson Organometallics 33 (16), 4183-4191, 2014 | 59 | 2014 |
Reaction of Criegee intermediate with nitric acid at the air–water interface M Kumar, J Zhong, XC Zeng, JS Francisco Journal of the American Chemical Society 140 (14), 4913-4921, 2018 | 58 | 2018 |
A gas-to-particle conversion mechanism helps to explain atmospheric particle formation through clustering of iodine oxides JC Gómez Martín, TR Lewis, MA Blitz, JMC Plane, M Kumar, JS Francisco, ... Nature communications 11 (1), 4521, 2020 | 57 | 2020 |
Photodissociation of Co− C bond in methyl-and ethylcobalamin: an insight from TD-DFT calculations P Lodowski, M Jaworska, T Andruniów, M Kumar, PM Kozlowski The Journal of Physical Chemistry B 113 (19), 6898-6909, 2009 | 56 | 2009 |
Direct observation of vinyl hydroperoxide F Liu, Y Fang, M Kumar, WH Thompson, MI Lester Physical Chemistry Chemical Physics 17 (32), 20490-20494, 2015 | 52 | 2015 |
Role of tunable acid catalysis in decomposition of α-hydroxyalkyl hydroperoxides and mechanistic implications for tropospheric chemistry M Kumar, DH Busch, B Subramaniam, WH Thompson The Journal of Physical Chemistry A 118 (41), 9701-9711, 2014 | 51 | 2014 |
Criegee intermediate-hydrogen sulfide chemistry at the air/water interface M Kumar, J Zhong, JS Francisco, XC Zeng Chemical science 8 (8), 5385-5391, 2017 | 44 | 2017 |
Organic acids tunably catalyze carbonic acid decomposition M Kumar, DH Busch, B Subramaniam, WH Thompson The Journal of Physical Chemistry A 118 (27), 5020-5028, 2014 | 42 | 2014 |
Mechanistic Insight into the Reaction of Organic Acids with SO3 at the Air–Water Interface J Zhong, H Li, M Kumar, J Liu, L Liu, X Zhang, XC Zeng, JS Francisco Angewandte Chemie 131 (25), 8439-8443, 2019 | 41 | 2019 |
Elemental sulfur aerosol-forming mechanism M Kumar, JS Francisco Proceedings of the National Academy of Sciences 114 (5), 864-869, 2017 | 41 | 2017 |