[Wien] somethint about the symmetry in the struct file

姜若诗 ruoshijiang at sjtu.edu.cn
Fri Jan 11 08:33:06 CET 2019


    Hello,I want to ask something about the symmetry matrix in the case.struct.
If I change the order of the symmetry matrix in the case.struct.  For example, the first matrix is not unitary,I change the eighth matrix and the first matrix in the case.struct_st in ordet to make sure the first one is unitary,then I run it.Will it have some influence to my result?
     Wish your reply.
                                                                 Sincerely
                                                                  Jasmine
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