Results 271 to 280 of about 584,217 (286)

Scaling Relations and Kinetic Monte Carlo Simulations To Bridge the Materials Gap in Heterogeneous Catalysis

ACS Catalysis, 2017
Mikkel Jørgensen, Henrik Grönbeck
exaly  

Monte Carlo simulations

2006
openaire   +1 more source

Theoretical foundations of dynamical Monte Carlo simulations

Journal of Chemical Physics, 1991
Kristen A Fichthorn
exaly  

The Monte Carlo method for the solution of charge transport in semiconductors with applications to covalent materials

Reviews of Modern Physics, 1983
exaly  

Molecular dynamics and Monte Carlo simulations as powerful tools for study of interfacial adsorption behavior of corrosion inhibitors in aqueous phase: A review

Journal of Molecular Liquids, 2018
Chandrabhan Verma, Hassane Lgaz, Eno E Ebenso   +2 more
exaly  

Monte Carlo Simulation

2019
openaire   +1 more source

Monte Carlo Simulation

2014
openaire   +1 more source

Monte Carlo Simulation

2022
openaire   +1 more source

Monte Carlo Simulation

2005
openaire   +1 more source

Temperature dependence of TIP3P, SPC, and TIP4P water from NPT Monte Carlo simulations: Seeking temperatures of maximum density

Journal of Computational Chemistry, 1998
exaly