BHSMS: a new software for searching the most stable structure of clusters based on the improved basin hopping algorithm.
A new efficient global-minimum search package named BHSMS was developed to search for the most stable structure of both atomic and molecular clusters and has remarkable compatibility with other quantum-chemistry software.
Yang-Yang Zhang, Yu Cheng, Shu-Wen Zhang et al.
· Physical Chemistry, Chemical... · 0 citations