scholarly journals Self-learning kinetic Monte Carlo method: Application to Cu(111)

2005 ◽  
Vol 72 (11) ◽  
Author(s):  
Oleg Trushin ◽  
Altaf Karim ◽  
Abdelkader Kara ◽  
Talat S. Rahman
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Method ◽  
Kinetic Monte Carlo ◽  
Kinetic Monte Carlo Method ◽  
Self Learning

scholarly journals Optimization of the Kinetic Activation-Relaxation Technique, an off-lattice and self-learning kinetic Monte-Carlo method

2012 ◽  
Vol 341 ◽  
pp. 012007 ◽  
Author(s):  
Jean-François Joly ◽  
Laurent Karim Béland ◽  
Peter Brommer ◽  
Fedwa El-Mellouhi ◽  
Normand Mousseau
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Method ◽  
Kinetic Monte Carlo ◽  
Relaxation Technique ◽  
Kinetic Monte Carlo Method ◽  
Self Learning

scholarly journals The Activation-Relaxation Technique: ART Nouveau and Kinetic ART

2012 ◽  
Vol 2012 ◽  
pp. 1-14 ◽  
Author(s):  
Normand Mousseau ◽  
Laurent Karim Béland ◽  
Peter Brommer ◽  
Jean-François Joly ◽  
Fedwa El-Mellouhi ◽  
...  
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Method ◽  
Search Algorithm ◽  
Kinetic Monte Carlo ◽  
Relaxation Technique ◽  
Art Nouveau ◽  
Kinetic Monte Carlo Method ◽  
Kinetic Art ◽  
Point Search ◽  
Self Learning

The evolution of many systems is dominated by rare activated events that occur on timescale ranging from nanoseconds to the hour or more. For such systems, simulations must leave aside the full thermal description to focus specifically on mechanisms that generate a configurational change. We present here the activation relaxation technique (ART), an open-ended saddle point search algorithm, and a series of recent improvements to ART nouveau and kinetic ART, an ART-based on-the-fly off-lattice self-learning kinetic Monte Carlo method.

Simulation of degradation of the organic contaminants ethylene glycol and phenol by iron nanoparticles using the kinetic Monte Carlo method

RSC Advances ◽  
2014 ◽  
Vol 4 (62) ◽  
pp. 32928-32933 ◽  
Author(s):  
Hamed Moradmand Jalali
Keyword(s):  
Hydrogen Peroxide ◽  
Monte Carlo Simulation ◽  
Monte Carlo ◽  
Monte Carlo Method ◽  
Ethylene Glycol ◽  
Organic Contaminants ◽  
Iron Nanoparticles ◽  
Kinetic Monte Carlo ◽  
Kinetic Monte Carlo Method ◽  
System P

We applied kinetic Monte Carlo simulation to study the kinetics and mechanisms of the degradation of the organic pollutants ethylene glycol and phenol by iron(iii) nanoparticles and hydrogen peroxide as the catalytic system.

Silver monolayer formation on Cu(110) by kinetic Monte Carlo method

2019 ◽  
Vol 134 (4) ◽  
Author(s):  
Moloudi Dardouri ◽  
Khalid Sbiaai ◽  
Abdessamad Hassani ◽  
Abdellatif Hasnaoui ◽  
Yahia Boughaleb ◽  
...  
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Method ◽  
Kinetic Monte Carlo ◽  
Kinetic Monte Carlo Method ◽  
Monolayer Formation
Sign in / Sign up

Export Citation Format

Share Document