Optimal search methods for selecting distributed species in Gillespie-based kinetic Monte Carlo
Alessandro D. Trigilio, Yoshi W. Marien, Mariya Edeleva, Paul Van Steenberge, Dagmar D’hooge
Topics & Concepts
Monte Carlo methodComputer scienceMonte Carlo tree searchKinetic Monte CarloPopulationSearch algorithmAlgorithmStatistical physicsMathematical optimizationMathematicsStatisticsPhysicsDemographySociologyCatalytic Processes in Materials ScienceMachine Learning in Materials ScienceAdvanced Chemical Physics Studies