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Variable cell nudged elastic band method for studying solid-solid structural phase transitions.
Guang-Rui Qian
Xiao Dong
Xiang-Feng Zhou
Yongjun Tian
Artem R. Oganov
Hui-Tian Wang
Published in:
Comput. Phys. Commun. (2013)
Keyphrases
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phase transition
three dimensional
dynamic programming
similarity measure