Alessandro D. Trigilio

Gillespie-Driven kinetic Monte Carlo Algorithms to Model Events for Bulk or Solution (Bio)Chemical Systems Containing Elemental and Distributed Species

Alessandro D. Trigilio, Yoshi W. Marien, Paul Van Steenberge et al. · Industrial & Engineering Chemistry Research · 2020 · 101 citations

Engineering, Monte Carlo Methods, Distributed Species +22

Optimal search methods for selecting distributed species in Gillespie-based kinetic Monte Carlo

Alessandro D. Trigilio, Yoshi W. Marien, Mariya Edeleva et al. · Computers & Chemical Engineering · 2021 · 24 citations · Full text

Monte Carlo, Evolutionary Biology, Computational Biology +7

Kinetic Monte Carlo residence time distributions and kinetics in view of extrusion-based polymer modification and recycling

Kyann De Smit, Mariya Edeleva, Alessandro D. Trigilio et al. · Reaction Chemistry & Engineering · 2022 · 18 citations · Full text

Chemical Kinetics, Engineering, Soft Matter +17

Toward an Automated Convergence Tool for Kinetic Monte Carlo Simulation of Conversion, Distributions, and Their Averages in Non-dispersed Phase Linear Chain-Growth Polymerization

Alessandro D. Trigilio, Yoshi W. Marien, Paul Van Steenberge et al. · Industrial & Engineering Chemistry Research · 2023 · 18 citations · Full text

Engineering, Simulation, Automated Convergence Tool +19

Coupled matrix-based Monte Carlo modeling for a mechanistic understanding of poly (methyl methacrylate) thermochemical recycling kinetics

Eli K. C. Moens, Yoshi W. Marien, Freddy L. Figueira et al. · Chemical Engineering Journal · 2023 · 18 citations · Full text

Chemical Kinetics, Engineering, Material Simulation +16