Simulating terahertz field-induced ferroelectricity in quantum paraelectric SrTiO$_3$

Bibliographic Details
Title: Simulating terahertz field-induced ferroelectricity in quantum paraelectric SrTiO$_3$
Authors: Shin, Dongbin, Latini, Simone, Schafer, Christian, Sato, Shunsuke A., Baldini, Edoardo, De Giovannini, Umberto, Hubener, Hannes, Rubio, Angel
Publication Year: 2021
Collection: Condensed Matter
Subject Terms: Condensed Matter - Materials Science
More Details: Recent experiments have demonstrated that light can induce a transition from the quantum paraelectric to the ferroelectric phase of SrTiO$_3$. Here, we investigate this terahertz field-induced ferroelectric phase transition by solving the time-dependent lattice Schr\"odinger equation based on first-principles calculations. We find that ferroelectricity originates from a light-induced mixing between ground and first excited lattice states in the quantum paraelectric phase. In agreement with the experimental findings, our study shows that the non-oscillatory second harmonic generation signal can be evidence of ferroelectricity in SrTiO$_3$. We reveal the microscopic details of this exotic phase transition and highlight that this phenomenon is a unique behavior of the quantum paraelectric phase.
Comment: 13 pages, 3 figures
Document Type: Working Paper
DOI: 10.1103/PhysRevLett.129.167401
Access URL: http://arxiv.org/abs/2106.03957
Accession Number: edsarx.2106.03957
Database: arXiv
More Details
DOI:10.1103/PhysRevLett.129.167401