| A versatile series of nickel (II) complexes derived from tetradentate imine/pyridyl ligands and various pseudohalides: azide and cyanate compared M Habib, TK Karmakar, G Aromí, J Ribas-Arino, HK Fun, ... Inorganic chemistry 47 (10), 4109-4117, 2008 | 74 | 2008 |
| Common defects accelerate charge separation and reduce recombination in CNT/molecule composites: atomistic quantum dynamics R Sarkar, M Kar, M Habib, G Zhou, T Frauenheim, P Sarkar, S Pal, ... Journal of the American Chemical Society 143 (17), 6649-6656, 2021 | 49 | 2021 |
| Ultrafast, asymmetric charge transfer and slow charge recombination in porphyrin/CNT composites demonstrated by time-domain atomistic simulation R Sarkar, M Habib, S Pal, OV Prezhdo Nanoscale 10 (26), 12683-12694, 2018 | 31 | 2018 |
| Role of chalcogens in the exciton relaxation dynamics of chalcogenol-functionalized CdSe QD: A time-domain atomistic simulation M Habib, M Kar, S Pal, P Sarkar Chemistry of Materials 31 (11), 4042-4050, 2019 | 25 | 2019 |
| Molecular engineering of anchoring groups for designing efficient triazatruxene-based organic dye-sensitized solar cells NN Ghosh, M Habib, A Pramanik, P Sarkar, S Pal New Journal of Chemistry 43 (17), 6480-6491, 2019 | 21 | 2019 |
| Tuning the BODIPY core for its potential use in DSSC: a quantum chemical approach NN Ghosh, M Habib, A Pramanik, P Sarkar, S Pal Bulletin of Materials Science 41, 1-10, 2018 | 19 | 2018 |
| Unambiguous hydrogenation of CO 2 by coinage-metal hydride anions: an intuitive idea based on in silico experiments M Habib, R Sarkar, S Biswas, A Pramanik, P Sarkar, S Pal Physical Chemistry Chemical Physics 21 (14), 7483-7490, 2019 | 14 | 2019 |
| Computational design of some TTF-substituted acene-based dyes for solar cell application using hollow ZnO quantum dot as acceptor M Habib, S Saha, R Sarkar, A Pramanik, P Sarkar, S Pal Computational and Theoretical Chemistry 1136, 10-17, 2018 | 12 | 2018 |
| Mixed metals slow down nonradiative recombination in saddle-shaped porphyrin nanorings: a time-domain atomistic simulation R Sarkar, M Habib, SM Kovalenko, S Pal, OV Prezhdo The Journal of Physical Chemistry C 125 (30), 16620-16628, 2021 | 11 | 2021 |
| Tuning charge transfer and recombination in exTTF/CNT nanohybrids by choice of chalcogen: A time-domain density functional analysis R Sarkar, M Habib, S Pal, OV Prezhdo Journal of Applied Physics 129 (2), 2021 | 11 | 2021 |
| Structural rigidity accelerates quantum decoherence and extends carrier lifetime in porphyrin nanoballs: a time domain atomistic simulation R Sarkar, M Habib, M Kar, A Pramanik, S Pal, P Sarkar Nanoscale Advances 2 (4), 1502-1511, 2020 | 11 | 2020 |
| Controlling the charge transfer and recombination dynamics in hollow zno qd based dye sensitized solar cell: An insight from ab initio simulation M Habib, NN Ghosh, R Sarkar, A Pramanik, P Sarkar, S Pal Chemical Physics Letters 709, 21-25, 2018 | 10 | 2018 |
| Controlling charge carrier dynamics in porphyrin nanorings by optically active templates S Mondal, U Chowdhury, S Dey, M Habib, C Mora Perez, T Frauenheim, ... The Journal of Physical Chemistry Letters 14 (50), 11384-11392, 2023 | 7 | 2023 |
| Symmetrical linkage in porphyrin nanoring suppressed the electron–hole recombination demonstrated by nonadiabatic molecular dynamics R Sarkar, M Habib, S Pal The Journal of Physical Chemistry Letters 13 (31), 7213-7219, 2022 | 6 | 2022 |
| Benign routes for the syntheses of polydentate Schiff base and their lanthanide complexes M Habib, S Sain, B Das, SK Chandra JOURNAL OF THE INDIAN CHEMICAL SOCIETY 88 (10), 1501-1508, 2011 | | 2011 |
| Bivalent copper compounds With tridentate ligands supported by two labile donors: Syntheses, structure, magnetic and spectroscopic properties M Habib, B Das, SK Chandra Journal of the Indian Chemical Society 88 (4), 491, 2011 | | 2011 |
