Identification of post-pyrite phase transitions in SiO2 by a genetic algorithm
Author(s) -
Shunqing Wu,
Koichiro Umemoto,
Min Ji,
Cai-Zhuang Wang,
K. M. Ho,
Renata M. Wentzcovitch
Publication year - 2011
Publication title -
physical review b
Language(s) - English
Resource type - Journals
eISSN - 1538-4489
pISSN - 1098-0121
DOI - 10.1103/physrevb.83.184102
Subject(s) - pyrite , enthalpy , phase transition , perovskite (structure) , phase (matter) , materials science , thermodynamics , physics , crystallography , chemistry , quantum mechanics , metallurgy
US Department of Energy, Basic Energy Sciences, Division of Materials Science and Engineering [DE-AC02-07CH11358]; NSF [EAR-0757903, EAR-0810272, EAR-1047629, ATM-0426757]
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