In this thesis, we attempt a new method, the statistical supercell method, to calculate the electronic structure of a mixedcrystal.
在本论文中,我们尝试用一种全新的计算方法——统计超原胞法来计算混晶的电子结构。
2
The powder SHG effect of the mixedcrystal was measured, and the relationship between the SHG effect and the crystal struture is discussed.
并测试了该混合晶体的二次谐波效应;讨论了二次谐波效应与晶体结构的关系。
3
Band structure and mixedcrystal phenomenon seriously cause the deformation intensification coefficient too high, which is the main reason resulted in the difficult rolling.