Crystal structure prediction via particle-swarm optimization
نویسندگان
چکیده
منابع مشابه
Crystal structure prediction via particle-swarm optimization
We have developed a method for crystal structure prediction from “scratch” through particle-swarm optimization PSO algorithm within the evolutionary scheme. PSO technique is different with the genetic algorithm and has apparently avoided the use of evolution operators e.g., crossover and mutation . The approach is based on an efficient global minimization of free-energy surfaces merging total-e...
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ژورنال
عنوان ژورنال: Physical Review B
سال: 2010
ISSN: 1098-0121,1550-235X
DOI: 10.1103/physrevb.82.094116