Abstract
We investigate the electronic structure of superconductor Y Ba{sub 2} Cu{sub 3} O{sub 7-x} through a molecular cluster approach. The calculations are performed self consistently through a semi empirical L.C.A.O. technique, where different charge states are considered. The correlation effects are taken into account by configuration interaction procedure (INDO/CI). The results for the larger cluster yield a density of states showing a strong p-d covalency resulting in a width of around 8,0 eV for the valence band. The optical excitations is analyzed in detail and compared with the experimental data. (author) 18 refs., 2 figs., 1 tab.
Lima, G A.R.
[1]
- UNESP, Guaratingueta, SP (Brazil). Faculdade de Engenharia. Dept. de Fisica e Quimica
Citation Formats
Lima, G A.R.
Electronic structure of the Y Ba{sub 2} Cu{sub 3} O{sub 7-x} high temperature superconductor ceramic; Estrutura eletronica da ceramica supercondutora de alta temperatura Y Ba{sub 2} Cu{sub 3} O{sub 7-x}.
Brazil: N. p.,
1990.
Web.
Lima, G A.R.
Electronic structure of the Y Ba{sub 2} Cu{sub 3} O{sub 7-x} high temperature superconductor ceramic; Estrutura eletronica da ceramica supercondutora de alta temperatura Y Ba{sub 2} Cu{sub 3} O{sub 7-x}.
Brazil.
Lima, G A.R.
1990.
"Electronic structure of the Y Ba{sub 2} Cu{sub 3} O{sub 7-x} high temperature superconductor ceramic; Estrutura eletronica da ceramica supercondutora de alta temperatura Y Ba{sub 2} Cu{sub 3} O{sub 7-x}."
Brazil.
@misc{etde_329718,
title = {Electronic structure of the Y Ba{sub 2} Cu{sub 3} O{sub 7-x} high temperature superconductor ceramic; Estrutura eletronica da ceramica supercondutora de alta temperatura Y Ba{sub 2} Cu{sub 3} O{sub 7-x}}
author = {Lima, G A.R.}
abstractNote = {We investigate the electronic structure of superconductor Y Ba{sub 2} Cu{sub 3} O{sub 7-x} through a molecular cluster approach. The calculations are performed self consistently through a semi empirical L.C.A.O. technique, where different charge states are considered. The correlation effects are taken into account by configuration interaction procedure (INDO/CI). The results for the larger cluster yield a density of states showing a strong p-d covalency resulting in a width of around 8,0 eV for the valence band. The optical excitations is analyzed in detail and compared with the experimental data. (author) 18 refs., 2 figs., 1 tab.}
place = {Brazil}
year = {1990}
month = {Dec}
}
title = {Electronic structure of the Y Ba{sub 2} Cu{sub 3} O{sub 7-x} high temperature superconductor ceramic; Estrutura eletronica da ceramica supercondutora de alta temperatura Y Ba{sub 2} Cu{sub 3} O{sub 7-x}}
author = {Lima, G A.R.}
abstractNote = {We investigate the electronic structure of superconductor Y Ba{sub 2} Cu{sub 3} O{sub 7-x} through a molecular cluster approach. The calculations are performed self consistently through a semi empirical L.C.A.O. technique, where different charge states are considered. The correlation effects are taken into account by configuration interaction procedure (INDO/CI). The results for the larger cluster yield a density of states showing a strong p-d covalency resulting in a width of around 8,0 eV for the valence band. The optical excitations is analyzed in detail and compared with the experimental data. (author) 18 refs., 2 figs., 1 tab.}
place = {Brazil}
year = {1990}
month = {Dec}
}