The Electronic Structure of Copper Oxide Crystalline Compounds: I. LUC‐CNDO Approach to the Electronic Structure of Cu2O and CuO Crystals
Forskningsoutput: Tidskriftsbidrag › Artikel i vetenskaplig tidskrift
Abstract
LUC‐CNDO computation scheme and its valence theory applications are discussed. Electronic structure calculations of well‐known semiconductors Cu2O are reviewed. The parameters of CNDO scheme for copper–oxygen compounds are calibrated using the results of Cu2O band theory calculations and experimental data.
Detaljer
| Författare | |
|---|---|
| Externa organisationer |
|
| Forskningsområden | Ämnesklassifikation (UKÄ) – OBLIGATORISK
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| Originalspråk | engelska |
|---|---|
| Sidor (från-till) | 281-291 |
| Antal sidor | 11 |
| Tidskrift | physica status solidi (b) |
| Volym | 157 |
| Utgåva nummer | 1 |
| Status | Published - 1990 jan 1 |
| Publikationskategori | Forskning |
| Peer review utförd | Ja |
| Externt publicerad | Ja |
