Derivation of the residence time for kinetic Monte Carlo simulations
Clinton DeW. Van Siclen

TL;DR
This paper presents a method to accurately calculate the residence time in kinetic Monte Carlo simulations, enhancing the understanding of the temporal dynamics in stochastic physical systems.
Contribution
It introduces a novel approach to derive the residence time for kinetic Monte Carlo simulations, which was previously not explicitly formulated.
Findings
Derived a formula for residence time calculation
Improved accuracy of time estimation in simulations
Applicable to various stochastic physical systems
Abstract
The kinetic Monte Carlo method is a standard approach for simulating physical systems whose dynamics are stochastic or that evolve in a probabilistic manner. Here we show how to calculate the system time for such simulations.
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Taxonomy
TopicsMachine Learning in Materials Science · Advanced Chemical Physics Studies · Advanced Thermodynamics and Statistical Mechanics
