English

Electron dichotomy on the SrTiO$_3$ defect surface augmented by many-body effects

Materials Science 2016-03-17 v1 Strongly Correlated Electrons

Abstract

In a common paradigm, the electronic structure of condensed matter is divided into weakly and strongly correlated compounds. While conventional band theory usually works well for the former class, many-body effects are essential for the latter. Materials like the familiar SrTiO3_3 compound that bridge or even abandon this characterization scheme are highly interesting. Here it is shown by means of combining density functional theory with dynamical-mean field theory that oxygen vacancies on the STO (001) surface give rise to a dichotomy of weakly-correlated t2gt_{2g} low-energy quasiparticles and localized 'in-gap' states of dominant ege_g character with subtle correlation signature. We furthermore touch base with recent experimental work and study the surface instability towards magnetic order.

Keywords

Cite

@article{arxiv.1603.04986,
  title  = {Electron dichotomy on the SrTiO$_3$ defect surface augmented by many-body effects},
  author = {Frank Lechermann and Harald O. Jeschke and Aaram J. Kim and Steffen Backes and Roser Valenti},
  journal= {arXiv preprint arXiv:1603.04986},
  year   = {2016}
}

Comments

5 pages, 3 figures, supplementary material appended

R2 v1 2026-06-22T13:12:03.013Z