Catalytic decomposition of formic acid on Cu(100): Optimization and dynamic Monte Carlo simulation
Sign Up to like & getrecommendations! Published in 2020 at "Catalysis Communications"
DOI: 10.1016/j.catcom.2020.105942
Abstract: Abstract Dynamic Monte Carlo simulation and response surface methodology have been used to study optimum conditions for the heterogeneous catalytic formic acid decomposition reaction on Cu(100) for the first time. The mechanism, kinetic parameters, optimum… read more here.
Keywords: dynamic monte; monte carlo; formic acid; carlo simulation ... See more keywords
Dynamic Monte Carlo simulations of effects of nanoparticle on polymer crystallization in polymer solutions
Sign Up to like & getrecommendations! Published in 2018 at "Computational Materials Science"
DOI: 10.1016/j.commatsci.2018.02.009
Abstract: Abstract The presence of different nanoparticles can result in different polymer crystallization behaviors. Dynamic Monte Carlo simulations were used to study the effects of filler dimension and size on polymer crystallization. One-dimensional nanoparticle has the… read more here.
Keywords: dynamic monte; monte carlo; crystallization; carlo simulations ... See more keywords
Multiple DNA damages induced by water radiolysis demonstrated using a dynamic Monte Carlo code
Sign Up to like & getrecommendations! Published in 2025 at "Communications Chemistry"
DOI: 10.1038/s42004-025-01453-x
Abstract: Multiple DNA damage resulting from different nearby ionizations of water molecules is an important process of the initial step of radiobiological effects. Several important characteristics of the damaged DNA site such as the critical size… read more here.
Keywords: dna damage; damage; monte carlo; dna ... See more keywords