A Simple Reverse Monte Carlo Algorithm for Structure Simulation of Multi-Component Amorphous Solids

1997 ◽  
Vol 11 (24) ◽  
pp. 1047-1055 ◽  
Author(s):  
M. Andrecut
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Method ◽  
Amorphous Solids ◽  
Monte Carlo Algorithm ◽  
Reverse Monte Carlo ◽  
Structure Simulation ◽  
Reverse Monte Carlo Method

A simple Reverse Monte Carlo algorithm for structure simulations of multi-component amorphous solids is presented. The described algorithm is based on the standard reverse Monte Carlo method,1,2 developed for the monoatomic case, the application for poliatomic case being assured by using the Warren–Krutter–Morningstar approximation.3 An application for metal-metalloid glasses is also presented.

Molecular Modeling of Porous Carbons Using the Hybrid Reverse Monte Carlo Method

Langmuir ◽  
2006 ◽  
Vol 22 (24) ◽  
pp. 9942-9948 ◽  
Author(s):  
Surendra K. Jain ◽  
Roland J.-M. Pellenq ◽  
Jorge P. Pikunic ◽  
Keith E. Gubbins
Keyword(s):  
Monte Carlo ◽  
Molecular Modeling ◽  
Monte Carlo Method ◽  
Reverse Monte Carlo ◽  
Porous Carbons ◽  
Reverse Monte Carlo Method

Structural Modeling of Porous Carbons:  Constrained Reverse Monte Carlo Method

Langmuir ◽  
2003 ◽  
Vol 19 (20) ◽  
pp. 8565-8582 ◽  
Author(s):  
Jorge Pikunic ◽  
Christian Clinard ◽  
Nathalie Cohaut ◽  
Keith E. Gubbins ◽  
Jean-Michel Guet ◽  
...  
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Method ◽  
Structural Modeling ◽  
Reverse Monte Carlo ◽  
Porous Carbons ◽  
Reverse Monte Carlo Method

Some remarks on the reverse Monte Carlo method

1993 ◽  
Vol 191 (3-4) ◽  
pp. 217-219 ◽  
Author(s):  
W. van der Lugt ◽  
M. Winnink
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Method ◽  
Reverse Monte Carlo ◽  
Reverse Monte Carlo Method
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