Результаты исследований: Научные публикации в периодических изданиях › статья › Рецензирование
A method is proposed for constructing appropriate sets of special points in the Brillouin zone in which the extended unit cell method is used with a subsequent shift from the center of the reduced Brillouin zone. The proposed method offers several advantages over the commonly used Monkhorst-Pack method. The difference in the construction of sets of special points for the direct and reciprocal lattices is discussed for crystals belonging to a nonsymmorphic space group. The cases of a planar square lattice and an fee lattice are considered to illustrate general results.
| Язык оригинала | английский |
|---|---|
| Страницы (с-по) | 1213-1224 |
| Число страниц | 12 |
| Журнал | Physics of the Solid State |
| Том | 46 |
| Номер выпуска | 7 |
| DOI | |
| Состояние | Опубликовано - июл 2004 |
ID: 84354365