Abstract
We consider the properties of charged domain walls in ferroelectrics as a quantum problem. This includes determination of self-consistent attracting 1D potential for compensating charge carriers, the number and positions of discrete energy levels in this potential, dependencies on the ferroelectric characteristics, as well as the spatial structure and formation energy of the wall. Our description is based on the Hartree and Thomas-Fermi methods and Landau theory for the ferroelectric transitions. Changeover from a few to many quantum levels (with the electron binding energies eV) is controlled by a single characteristic parameter. The quantum models well describe the core of the wall, whose width is typically nm. Additionally, the walls possess pronounced long-range tails which are due to trap recharging. For the trap concentration , the tail length is of the scale. On the distances much larger than the walls are electrically uncoupled from each other and the crystal faces.
2 More- Received 29 September 2015
- Revised 18 November 2015
DOI:https://doi.org/10.1103/PhysRevB.92.214112
©2015 American Physical Society