Silabrata Pahari

DFT–kMC Analysis for Identifying Novel Bimetallic Electrocatalysts for Enhanced NRR Performance by Suppressing HER at Ambient Conditions Via Active-Site Separation

Chi H. Lee, Silabrata Pahari, Niranjan Sitapure et al. · ACS Catalysis · 2022 · 67 citations

Engineering, Chemistry, Theoretical Electrochemistry +17

Hybrid modeling of first-principles and machine learning: A step-by-step tutorial review for practical implementation

Parth Shah, Silabrata Pahari, Raj Bhavsar et al. · Computers & Chemical Engineering · 2024 · 62 citations

Artificial Intelligence, Engineering, Machine Learning +12

Investigating High-Performance Non-Precious Transition Metal Oxide Catalysts for Nitrogen Reduction Reaction: A Multifaceted DFT–kMC–LSTM Approach

Chi H. Lee, Silabrata Pahari, Niranjan Sitapure et al. · ACS Catalysis · 2023 · 56 citations · Full text

Multifaceted Dft–kmc–lstm Approach, Engineering, Computational Chemistry +16

A slip-spring framework to study relaxation dynamics of entangled wormlike micelles with kinetic Monte Carlo algorithm

Silabrata Pahari, Bhavana Bhadriraju, Mustafa Akbulut et al. · Journal of Colloid and Interface Science · 2021 · 37 citations · Full text

Relaxation Process, Molecular Kinetics, Engineering +10

Optimal pumping schedule with high-viscosity gel for uniform distribution of proppant in unconventional reservoirs

Silabrata Pahari, Parth Bhandakkar, Mustafa Akbulut et al. · Energy · 2020 · 30 citations · Full text

Engineering, Unconventional Reservoirs, Uniform Distribution +7