Dr. Bhaskar Mondal
Dr. Bhaskar Mondal
Assistant Professor, IIT Mandi, Himachal Pradesh
Verified email at iitmandi.ac.in - Homepage
Cited by
Cited by
Organic super-electron-donors: initiators in transition metal-free haloarene–arene coupling
S Zhou, GM Anderson, B Mondal, E Doni, V Ironmonger, M Kranz, T Tuttle, ...
Chemical Science 5 (2), 476-482, 2014
The synthesis of highly active iridium (I) complexes and their application in catalytic hydrogen isotope exchange
JA Brown, AR Cochrane, S Irvine, WJ Kerr, B Mondal, JA Parkinson, ...
Advanced Synthesis & Catalysis 356 (17), 3551-3562, 2014
Control in the Rate-Determining Step Provides a Promising Strategy To Develop New Catalysts for CO2 Hydrogenation: A Local Pair Natural Orbital Coupled …
B Mondal, F Neese, S Ye
Inorganic chemistry 54 (15), 7192-7198, 2015
Bio-inspired mechanistic insights into CO2 reduction
B Mondal, J Song, F Neese, S Ye
Current Opinion in Chemical Biology 25, 103-109, 2015
Toward Rational Design of 3d Transition Metal Catalysts for CO2 Hydrogenation Based on Insights into Hydricity-Controlled Rate-Determining Steps
B Mondal, F Neese, S Ye
Inorganic Chemistry 55 (11), 5438-5444, 2016
Nonclassical single-state reactivity of an oxo-iron (IV) complex confined to triplet pathways
C Kupper, B Mondal, J Serrano-Plana, I Klawitter, F Neese, M Costas, ...
Journal of the American Chemical Society 139 (26), 8939-8949, 2017
Overturning established chemoselectivities: Selective reduction of arenes over malonates and cyanoacetates by photoactivated organic electron donors
E Doni, B Mondal, S O’Sullivan, T Tuttle, JA Murphy
Journal of the American Chemical Society 135 (30), 10934-10937, 2013
Practically convenient and industrially-aligned methods for iridium-catalysed hydrogen isotope exchange processes
AR Cochrane, C Idziak, WJ Kerr, B Mondal, LC Paterson, T Tuttle, ...
Organic & biomolecular chemistry 12 (22), 3598-3603, 2014
Magnetic circular dichroism evidence for an unusual electronic structure of a tetracarbene–oxoiron (IV) complex
S Ye, C Kupper, S Meyer, E Andris, R Navratil, O Krahe, B Mondal, ...
Journal of the American Chemical Society 138 (43), 14312-14325, 2016
Electronic Structure Contributions of Non-Heme Oxo-Iron (V) Complexes to the Reactivity
B Mondal, F Neese, E Bill, S Ye
Journal of the American Chemical Society 140 (30), 9531–9544, 2018
Nucleophilic degradation of fenitrothion insecticide and performance of nucleophiles: a computational study
D Mandal, B Mondal, AK Das
The Journal of Physical Chemistry A 116 (10), 2536-2546, 2012
High‐Valent Iron‐Oxo and‐Nitrido Complexes: Bonding and Reactivity
B Mondal, L Roy, F Neese, S Ye
Israel Journal of Chemistry 56 (9-10), 763-772, 2016
Isomerization and decomposition of a model nerve agent: a computational analysis of the reaction energetics and kinetics of dimethyl ethylphosphonate
D Mandal, B Mondal, AK Das
The Journal of Physical Chemistry A 114 (39), 10717-10725, 2010
Electron paramagnetic resonance signature of tetragonal low spin iron (V)-nitrido and-oxo complexes derived from the electronic structure analysis of heme and non-heme archetypes
HC Chang, B Mondal, H Fang, F Neese, E Bill, S Ye
Journal of the American Chemical Society 141 (6), 2421-2434, 2019
Reduction of CO 2 by a masked two-coordinate cobalt (i) complex and characterization of a proposed oxodicobalt (ii) intermediate
L Roy, MH Al-Afyouni, DE DeRosha, B Mondal, IM DiMucci, KM Lancaster, ...
Chemical Science 10, 918-929, 2019
Computational study on the growth of gallium nitride and a possible source of oxygen impurity
B Mondal, D Mandal, D Ghosh, AK Das
The Journal of Physical Chemistry A 114 (14), 5016-5025, 2010
Orthogonal selectivity in C–H olefination: synthesis of branched vinylarene with unactivated aliphatic substitution
S Agasti, B Mondal, TK Achar, SK Sinha, A Sarala Suseelan, KJ Szabo, ...
ACS Catalysis 9 (10), 9606-9613, 2019
Arsine and its fluoro, chloro derivatives: a computational thermochemical study
S Bagchi, B Mondal, D Ghosh, AK Das
Molecular Physics 108 (1), 1-11, 2010
Spectroscopic properties of I2–Rg (Rg= He, Ne, Ar) van der Waals complexes
S Pakhira, B Mondal, AK Das
Chemical Physics Letters 505 (4-6), 81-86, 2011
Towards a quantitative understanding of palladium metal scavenger performance: an electronic structure calculation approach
B Mondal, RD Wilkes, JM Percy, T Tuttle, RJG Black, C North
Dalton Transactions 43 (2), 469-478, 2014
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