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Variable cell nudged elastic band method for studying solid–solid structural phase transitions
Qian, Guang-Rui, Dong, Xiao, Zhou, Xiang-Feng, Tian, Yongjun, Oganov, Artem R., Wang, Hui-TianVolume:
184
Language:
english
Journal:
Computer Physics Communications
DOI:
10.1016/j.cpc.2013.04.004
Date:
September, 2013
File:
PDF, 1.57 MB
english, 2013