Theory¶
See the following papers.
- Zhong, David Vanderbilt, and K. M. Rabe. “First-principles theory of ferroelectric phase transitions for perovskites: The case of BaTiO3 ,” Phys. Rev. B, 52, 6301 (1995).
- “Ewald summation for ferroelectric perovksites with charges and dipoles”, by D. Wang, J. Liu, J. Zhang, S. Raza, X. Chen, and C.-L. Jia.