[Wien] simple question about kgen
翠玉 耿
cygeng77 at yahoo.com.cn
Sat Dec 6 07:31:32 CET 2003
Dear prof.:
thank you very much. one more question: there is about 100 atoms/unitcell in my system, after input one k-points in the BZ, it generates 2 k-mesh in the IBZ. Is this possible? I post the klist file here: 1 0 0 0 2 1.0 -7.0 1.5 1 k, div: ( 2 1 1)
2 1 0 0 2 1.0
PS: my system only x-direction is periodic, for I add vacuum to y and z direction.
Best regards
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