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ÎïÀíС°×Çó½Ì Explain the possibility of reasons, which the surface of Brillouin zone, as a large number of empty conduction band states occurred why? In order to, two times more than the number of valence band are empty? and frequency grid points are adopted in optical properties calculations? However, author/s have compared the conventional electronic structure calculations of VB? explain briefly. ÕâÑù·Òë¶ÔÂ𣬽âÊͲ¼ÀïÔ¨Çø±íÃæÎªÊ²Ã´»á³öÏÖ´óÁ¿¿Õµ¼´ø£¬ÎªÁËʹµ¼´øÊǿմøµÄÊýÁ¿¶àÓÚ¼Û´øµÄÁ½±¶£¬ÔÚ¹âÑ§ÌØÐÔ¼ÆËãÖвÉȡƵÂʹ۵㣬µ«ÊÇ×÷Õß²ÎÕÕÁ˼۴øµÄ¾µäµç×ӽṹËã·¨ Õâ¸öÓ¦¸ÃÔõô½âÊÍ£¬ |
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