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Thermodynamic calculations using reverse Monte Carlo.
Agrahari G, Chatterjee A. Agrahari G, et al. Among authors: chatterjee a. Phys Rev E. 2021 Oct;104(4-1):044129. doi: 10.1103/PhysRevE.104.044129. Phys Rev E. 2021. PMID: 34781448
Spatially adaptive grand canonical ensemble Monte Carlo simulations.
Chatterjee A, Katsoulakis MA, Vlachos DG. Chatterjee A, et al. Phys Rev E Stat Nonlin Soft Matter Phys. 2005 Feb;71(2 Pt 2):026702. doi: 10.1103/PhysRevE.71.026702. Epub 2005 Feb 9. Phys Rev E Stat Nonlin Soft Matter Phys. 2005. PMID: 15783451
Building a kinetic Monte Carlo model with a chosen accuracy.
Bhute VJ, Chatterjee A. Bhute VJ, et al. Among authors: chatterjee a. J Chem Phys. 2013 Jun 28;138(24):244112. doi: 10.1063/1.4812319. J Chem Phys. 2013. PMID: 23822232
The kinetic Monte Carlo (KMC) method is a popular modeling approach for reaching large materials length and time scales. ...Recently, we had developed for the first time an error measure for KMC in Bhute and Chatterjee [J. Chem. Phys. 138, 084103 (2013)]. The error …
The kinetic Monte Carlo (KMC) method is a popular modeling approach for reaching large materials length and time scales. ...Recently, …
3,943 results