English

Quantum-Geometric Origin of Out-of-plane Stacking Ferroelectricity

Materials Science 2024-05-13 v2 Mesoscale and Nanoscale Physics

Abstract

Stacking ferroelectricity (SFE) has been discovered in a wide range of van der Waals materials and holds promise for applications, including photovoltaics and high-density memory devices. We show that the microscopic origin of out-of-plane stacking ferroelectric polarization can be generally understood as a consequence of nontrivial Berry phase borne out of an effective Su-Schrieffer-Heeger model description with broken sublattice symmetry, thus elucidating the quantum-geometric origin of polarization in the extremely non-periodic bilayer limit. Our theory applies to known stacking ferroelectrics such as bilayer transition-metal dichalcogenides in 3R and Td_{\rm d} phases, as well as general AB-stacked honeycomb bilayers with staggered sublattice potential. Our explanatory and self-consistent framework based on the quantum-geometric perspective establishes quantitative understanding of out-of-plane SFE materials beyond symmetry principles.

Keywords

Cite

@article{arxiv.2309.00728,
  title  = {Quantum-Geometric Origin of Out-of-plane Stacking Ferroelectricity},
  author = {Benjamin T. Zhou and Vedangi Pathak and Marcel Franz},
  journal= {arXiv preprint arXiv:2309.00728},
  year   = {2024}
}

Comments

5 + 20 pages, 2 + 3 figures. Texts revised with Fig.2 updated. Comments are welcome