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Efficient Basin-Hopping Sampling of Reaction Intermediates through Molecular Fragmentation and Graph Theory Kim, Yeonjoon; Choi, Sunghwan; Kim, Woo Youn, JOURNAL OF CHEMICAL THEORY AND COMPUTATION, v.10, no.6, pp.2419 - 2426, 2014-06 |
New algorithm in the basin hopping Monte Carlo to find the global minimum structure of unary and, binary metallic nanoclusters Kim, Hyoung Gyu; Choi, Si-Kyung; Lee, HyuckMo, JOURNAL OF CHEMICAL PHYSICS, v.128, no.14, pp.144702-1 - 144702-4, 2008-04 |
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