| Автор | Peter Zapol |
| Автор | Ravindra Pandey |
| Автор | Max Seel |
| Автор | J Manuel Recio |
| Автор | Melvin C Ohmer |
| Дата выпуска | 1999-06-14 |
| dc.description | Structural, thermodynamic and electronic properties of CdGeAs<sub>2</sub> with chalcopyrite structure are investigated in the framework of density functional theory. We employ the linear combination of atomic orbitals method with the Gaussian basis sets and present the results for the equation of state, the Grüneisen constant, the electronic band structure and the pressure coefficients of the valence and conduction levels in CdGeAs<sub>2</sub>. |
| Формат | application.pdf |
| Издатель | Institute of Physics Publishing |
| Название | Density functional study of the structure, thermodynamics and electronic properties of CdGeAs<sub>2</sub> |
| Тип | paper |
| DOI | 10.1088/0953-8984/11/23/306 |
| Electronic ISSN | 1361-648X |
| Print ISSN | 0953-8984 |
| Журнал | Journal of Physics: Condensed Matter |
| Том | 11 |
| Первая страница | 4517 |
| Последняя страница | 4526 |
| Выпуск | 23 |
