Challenges of modeling nanostructured materials for photocatalytic water splitting B Samanta, Á Morales-García, F Illas, N Goga, JA Anta, S Calero, ... Chemical Society reviews, 2022 | 73 | 2022 |
Specificity of amino acid–aluminum cluster interaction and subsequent oxygen activation by the above complex B Samanta, T Sengupta, S Pal The Journal of Physical Chemistry C 122 (49), 28310-28323, 2018 | 16 | 2018 |
A comparative study of Bi, Sb, and BiSb for electrochemical nitrogen reduction leading to a new catalyst design strategy YJ Jang, TA Evans, B Samanta, K Zeng, MC Toroker, KS Choi Journal of Materials Chemistry A 9 (36), 20453-20465, 2021 | 15 | 2021 |
Cooperative Fe sites on transition metal (oxy) hydroxides drive high oxygen evolution activity in base Y Ou, LP Twight, B Samanta, L Liu, S Biswas, JL Fehrs, NA Sagui, ... Nature Communications 14 (1), 7688, 2023 | 12 | 2023 |
Energetics and structural behavior of asphaltene molecules near mica surface: Molecular simulation study B Samanta, MB Singh, A Malani Energy & fuels 34 (4), 4071-4083, 2020 | 6 | 2020 |
Aluminum cluster for CO and O2 adsorption B Samanta, T Sengupta, S Pal Journal of Molecular Modeling 25, 1-15, 2019 | 6 | 2019 |
Theoretical study of C–X [X= Cl, Br] bond activation on aluminum nanoclusters T Sadhukhan, B Samanta, SA Ansari, S Pal Theoretical Chemistry Accounts 135, 1-10, 2016 | 6 | 2016 |
Transferable Classical Force Field for Pure and Mixed Metal Halide Perovskites Parameterized from First-Principles JA Seijas-Bellido, B Samanta, K Valadez-Villalobos, JJ Gallardo, J Navas, ... Journal of Chemical Information and Modeling 62 (24), 6423-6435, 2022 | 5 | 2022 |
Effect of ligand attachment on the C–I bond dissociation process on aluminum nanoclusters: A DFT investigation T Sengupta, B Samanta, S Pal The Journal of Physical Chemistry C 121 (32), 17354-17364, 2017 | 4 | 2017 |
NiFe-mixed metal porphyrin aerogels as oxygen evolution reaction catalysts in alkaline electrolysers W Moschkowitsch, B Samanta, N Zion, HC Honig, DA Cullen, MC Toroker, ... Nanoscale 14 (48), 18033-18040, 2022 | 1 | 2022 |
NiOx passivation in perovskite solar cells: from surface reactivity to device performance J Mohanraj, B Samanta, O Almora, R Escalante, LF Marsal, S Jenatsch, ... arXiv preprint arXiv:2402.10286, 2024 | | 2024 |
Cooperative Fe-Sites in Nickel and Cobalt Oxyhydroxides LP Twight, Y Ou, B Samanta, L Liu, S Biswas, JL Fehrs, ... Electrochemical Society Meeting Abstracts 243, 2063-2063, 2023 | | 2023 |