[Pw_forum] Problem with the Band Structure Calculation

潘登 panda.deng.pan at gmail.com
Fri Mar 6 07:35:34 CET 2009

> Please try to point out clearly where your problem really is, otherwise noone will be able

A mor specific problem is that did I put it correctly for I4/mmm space
group in the strucure of "ibrav=6" and 2a 4d 4e coordinates in
ATOM_POSITION with crystal option.Are "ibrav=6" and crystal correct?I
though I shuold make sure this problem before checking the k_points.

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