A generic ionic potential for the alkaline-earth oxides and the anomalous crystal structure of ZnO
It is shown that 'compressible ion' potentials, which represent the results of ab initio electronic structure calculations on MgO and CaO and which represent their phase transitions accurately, can be transferred successfully to other alkaline earth oxides by substitution of accepted value...
| Autors principals: | , |
|---|---|
| Format: | Journal article |
| Idioma: | English |
| Publicat: |
1997
|