Developments of the heterogeneous and homogeneous CO2 hydrogenation to value-added C2+-based hydrocarbons and oxygenated products SC Mandal, A Das, D Roy, S Das, AS Nair, B Pathak Coordination Chemistry Reviews 471, 214737, 2022 | 23 | 2022 |
Unraveling the catalytically preferential pathway between the direct and indirect hydrogenation of CO 2 to CH 3 OH using N-heterocyclic carbene-based Mn (I) catalysts: a … A Das, SC Mandal, B Pathak Catalysis Science & Technology 11 (4), 1375-1385, 2021 | 15 | 2021 |
Mechanistic Exploration of CO 2 Conversion to Dimethoxymethane (DMM) Using Transition Metal (Co, Ru) Catalysts: An Energy Span Model A Das, SC Mandal, B Pathak Physical Chemistry Chemical Physics, 2022 | 10 | 2022 |
A Route Map of Machine Learning Approaches in Heterogeneous CO2 Reduction Reaction D Roy, A Das, S Manna, B Pathak The Journal of Physical Chemistry C 127 (2), 871-881, 2023 | 9 | 2023 |
Single Cu Atom Doping on Au11 Nanocluster: Its Implication toward Selectivity in C–C Coupling Reaction S Mukherjee, A Das, AK Das, A Sheriff, K Sunny, AS Nair, S Bhandary, ... Chemistry of Materials 35 (4), 1659-1666, 2023 | 8 | 2023 |
Ga and Zn Atom-Doped CuAl2O4(111) Surface-Catalyzed CO2 Conversion to Dimethyl Ether: Importance of Acidic Sites A Das, SC Mandal, S Das, B Pathak The Journal of Physical Chemistry C 126 (51), 21628-21637, 2022 | 6 | 2022 |
Diruthenium Catalyst for Hydrogen Production from Aqueous Formic Acid S Kushwaha, MK Awasthi, A Das, B Pathak, SK Singh Inorganic Chemistry 62 (21), 8080-8092, 2023 | 3 | 2023 |
Machine Learning Assisted Screening of MXene with Superior Anchoring Effect in Al–S Batteries S Manna, A Das, S Das, B Pathak ACS Materials Letters 6 (2), 572-582, 2024 | 1 | 2024 |
Sustainable Organic Photocatalysis for Site-Selective Hydrazocoupling of Electron-Rich Arenes B Das, SR Sahoo, A Das, B Pathak, D Sarkar Organic Letters 25 (42), 7733-7738, 2023 | 1 | 2023 |
Organic Additive for the Selective C 2-Product Formation on Cu (100): A Density Functional Theory Mechanistic Study A Das, SC Mandal, B Pathak Catalysis Science & Technology, 2023 | 1 | 2023 |
Subsurface Li Monolayer on Cu(111) Surfaces for Upgrading Ethanol to n-Butanol: A Computational Study M Tiwari, SC Mandal, A Das, B Pathak ACS Applied Nano Materials 6 (9), 7156-7165, 2023 | 1 | 2023 |
Unravelling CO2 Reduction Reaction Intermediates on High Entropy Alloy Catalysts: An Interpretable Machine Learning Approach to Establish Scaling Relations D Roy, S Charan Mandal, A Das, B Pathak Chemistry–A European Journal 30 (6), e202302679, 2024 | | 2024 |
Machine learning-based screening of Mn-PNP catalysts for the CO 2 reduction reaction using a region-wise ligand-encoded feature matrix A Das, D Roy, SC Mandal, B Pathak Energy Advances 3 (4), 854-860, 2024 | | 2024 |
Insights of the efficient hydrogen evolution reaction performance in bimetallic Au 4 Cu 2 nanoclusters A Devi, H Minhas, L Sahoo, S Gratious, A Das, S Mandal, B Pathak, ... Nanoscale 16 (4), 1758-1769, 2024 | | 2024 |