Electronic States in Two-Dimensional Triangular Cobalt Oxides: Role of Electronic Correlation
Strongly Correlated Electrons
2009-11-10 v2 Superconductivity
Abstract
We obtain the electronic states and structures of two-dimensional cobalt oxides, NaCoO (x=0, 0.35, 0.5 and 0.75) by utilizing the full-potential linear muffin-tin orbitals (FP-LMTO) methods, from which some essential electronic interaction parameters are estimated: the bare on-site Coulomb interaction of cobalt U=7.5 eV renormalizes to 5 eV for x=0.35, the hybridizations t and t are -1.40 and 0.70 eV, respectively. The density of states at E decreases from 6-7 states/eV in the local density approximation (LDA) to about 1.0 states/eV in the LDA+U scheme. The role of the intercalation of water molecules and the microscopic mechanism of the superconductivity in NaCoOmHO is discussed.
Cite
@article{arxiv.cond-mat/0307560,
title = {Electronic States in Two-Dimensional Triangular Cobalt Oxides: Role of Electronic Correlation},
author = {Liang-Jian Zou and J. -L. Wang and Z. Zeng},
journal= {arXiv preprint arXiv:cond-mat/0307560},
year = {2009}
}
Comments
minor errors corrected