叠熵理论：从材料基因到材料性能

廖名情, 王毅, 王义, 商顺利, 刘梓葵

Zentropy Theory: Bridging Materials Gene to Materials Properties

LIAO Mingqing, WANG William Yi, WANG Yi, SHANG Shun-Li, LIU Zi-Kui

图5 PbTiO3各个组态概率随温度的变化[47]

Fig.5 Probability of configurations as a function of temperature in PbTiO3[47] (p—probability, DW—domain wall, FEG—ground state of ferroelectric without DW, TC—critical temperature, the domain wall energies for 90DW and 180DW are 35 and 132 mJ/m2, respectively, which is taken from Ref.[58])