| Improved prediction of heat of mixing and segregation in metallic alloys using tunable mixing rule for embedded atom method S Divi, G Agrahari, SR Kadulkar, S Kumar, A Chatterjee Modelling and Simulation in Materials Science and Engineering 25 (8), 085011, 2017 | 17 | 2017 |
| Speed-up of Monte Carlo simulations by preparing starting off-lattice structures that are close to equilibrium G Agrahari, A Chatterjee The Journal of Chemical Physics 152 (4), 2020 | 10 | 2020 |
| Inferring layer-by-layer composition in Au-Ag nanoparticles using a combination of X-ray Photoelectron Spectroscopy and Monte Carlo simulations I Arif, G Agrahari, AK Gautam, A Chatterjee Surface Science 691, 121503, 2020 | 10 | 2020 |
| Thermodynamic calculations using reverse Monte Carlo G Agrahari, A Chatterjee Physical Review E 104 (4), 044129, 2021 | 9 | 2021 |
| Thermodynamic calculations using reverse Monte Carlo: convergence aspects, sources of error and guidelines for improving accuracy G Agrahari, A Chatterjee Molecular Simulation 48 (13), 1143-1154, 2022 | 8 | 2022 |
| Accelerated calculation of configurational free energy using a combination of reverse Monte Carlo and neural network models: Adsorption isotherm for 2D square and triangular … AK Ball, S Rana, G Agrahari, A Chatterjee arXiv preprint arXiv:2212.00287, 2022 | 5 | 2022 |
| Effect of Solvent on Segregation Behavior in Pt-Ni Bimetallic Alloy G Agrahari, A Sarkar, A Chatterjee Advances in Energy Research, Vol. 1: Selected Papers from ICAER 2017, 239-247, 2020 | | 2020 |
| Nano-Thermodynamic Model Based on Distribution Coefficients for Understanding Segregation in Metal Alloy Nano Particles G Agrahari, A Chatterjee 2019 AIChE Annual Meeting, 2019 | | 2019 |
| Relating Segregation Behavior in Metal Alloy Nano-Particles of Different Shapes and Sizes G Agrahari, A Chatterjee 2019 AIChE Annual Meeting, 2019 | | 2019 |
| A Computationally Efficient Procedure for Studying Segregation in Alloy Materials with Monte Carlo Simulations G Agrahari, A Chatterjee 2019 AIChE Annual Meeting, 2019 | | 2019 |
| Theoretical foundation for accelerated thermodynamic calculations using reverse monte carlo G Agrahari Mumbai, 0 | | |
Abhijit ChatterjeeIIT BombayVerified email at che.iitb.ac.in
