Engineering the Magnetic Properties of PtSe2 Monolayer Through Transition Metal Doping M Kar, R Sarkar, S Pal, P Sarkar Journal of Physics: Condensed Matter 31 (14), 145502, 2019 | 61 | 2019 |
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 | 50 | 2021 |
Lead Free Two-Dimensional Mixed Tin and Germanium Halide Perovskites for Photovoltaic Applications M Kar, R Sarkar, S Pal, P Sarkar The Journal of Physical Chemistry C 125 (1), 74-81, 2020 | 43 | 2020 |
Two-Dimensional CP3 Monolayer and Its Fluorinated Derivative with Promising Electronic and Optical Properties: A Theoretical Study M Kar, R Sarkar, S Pal, P Sarkar Physical Review B 101 (19), 195305, 2020 | 31 | 2020 |
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 |
Arene and Functionalized Arene Based Two Dimensional Organic-Inorganic Hybrid Perovskites For Photovoltaic Applications M Kar, A Ghosh, R Sarkar, S Pal, P Sarkar Journal of Computational Chemistry 42 (27), 1982-1990, 2021 | 23 | 2021 |
Tunable Electronic Structure of Two-Dimensional MoX2 (X=S,Se)/SnS2 van der Waals Heterostructures M Kar, R Sarkar, S Pal, P Sarkar The Journal of Physical Chemistry C 124 (39), 21357-21365, 2020 | 18 | 2020 |
Pathways for Improving the Photovoltaic Efficiency of Porphyrin and Phosphorene Antidot Lattice Nanocomposites: An Insight from a Theoretical Study M Kar, R Sarkar, S Pal, P Sarkar The Journal of Physical Chemistry C 123 (9), 5303-5311, 2019 | 18 | 2019 |
Edge-Modified Phosphorene Antidot Nanoflakes and Their van der Waals Heterojunctions for Solar Cell Applications M Kar, R Sarkar, S Pal, P Sarkar The Journal of Physical Chemistry C 123 (34), 20748-20756, 2019 | 17 | 2019 |
Periodically-Ordered One and Two Dimensional CdTe QD Superstructures: A Path Forward in Photovoltaics M Kar, B Rajbanshi, R Sarkar, S Pal, P Sarkar Physical Chemistry Chemical Physics 21 (35), 19391-19402, 2019 | 14 | 2019 |
Unambiguous Hydrogenation of CO2 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 |
Comparative Study on the Photovoltaic Properties of ZnX (X=S,Se,Te) QD/CNT Inorganic/Organic Hybrid Nanocomposites M Kar, S Saha, R Sarkar, S Pal, P Sarkar The Journal of Physical Chemistry C 124 (14), 7652-7660, 2020 | 13 | 2020 |
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 | 12 | 2020 |
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), 025501, 2021 | 11 | 2021 |
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 |
Isoelectronically Doped CdSe/Te Nanoalloys as Alternative Solar Cell Materials: Insight from Computational Analysis R Sarkar, S Sarkar, A Pramanik, P Sarkar, S Pal RSC Advances 6 (89), 86494-86501, 2016 | 7 | 2016 |
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 |