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Priya Das
Priya Das
Junior Research Fellow
在 visva-bharati.ac.in 的电子邮件经过验证 - 首页
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Molybdenum atom-mediated salphen-based covalent organic framework as a promising electrocatalyst for the nitrogen reduction reaction: A first-principles study
B Ball, P Das, P Sarkar
The Journal of Physical Chemistry C 125 (47), 26061-26072, 2021
422021
Theoretical investigation of a tetrazine based covalent organic framework as a promising anode material for sodium/calcium ion batteries
P Das, B Ball, P Sarkar
Physical Chemistry Chemical Physics 24 (36), 21729-21739, 2022
262022
Bifunctional Electrocatalytic Activity of Two-Dimensional Metallophthalocyanine-Based Metal–Organic-Frameworks for Overall Water Splitting: A DFT Study
P Das, B Ball, P Sarkar
ACS Catalysis 13 (24), 16307-16317, 2023
82023
Designing dithiolene and bis (iminothiolato)-based 1D metal-organic-frameworks for electrocatalytic hydrogen evolution reaction
P Das, B Ball, B Goswami, P Sarkar
Theoretical Chemistry Accounts 142 (5), 41, 2023
32023
A nitrogen-rich two dimensional covalent organic framework with multiple carbonyls as a highly efficient anchoring material for lithium–sulfur batteries
P Das, P Sarkar
Physical Chemistry Chemical Physics 25 (44), 30536-30542, 2023
22023
Hot Carrier Controlled Nitrogen Fixation Reaction in Metal-Free Boron-Anchored Aza-COF: Insight from Nonadiabatic Molecular Dynamics Simulation
P Das, A Ghosh, P Sarkar
The Journal of Physical Chemistry Letters 15 (18), 4898-4905, 2024
2024
Hot carrier relaxation dynamics of an aza-covalent organic framework during photoexcitation: An insight from ab initio quantum dynamics
A Ghosh, P Das, S Kumar, P Sarkar
The Journal of Chemical Physics 160 (16), 2024
2024
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