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Scalable parallel Monte Carlo algorithm for atomistic simulations of precipitation in alloys

โœ Scribed by Sadigh, Babak; Erhart, Paul; Stukowski, Alexander; Caro, Alfredo; Martinez, Enrique; Zepeda-Ruiz, Luis


Book ID
118229896
Publisher
The American Physical Society
Year
2012
Tongue
English
Weight
583 KB
Volume
85
Category
Article
ISSN
1098-0121

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A scalable parallel Monte Carlo method f
โœ Malek O. Khan; Gareth Kennedy; Derek Y. C. Chan ๐Ÿ“‚ Article ๐Ÿ“… 2004 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 234 KB

## Abstract We present a method of parallelizing flat histogram Monte Carlo simulations, which give the free energy of a molecular system as an output. In the serial version, a constant probability distribution, as a function of any system parameter, is calculated by updating an external potential