Originally posted by 夕阳西下 at 2011-01-15 09:29:03:

如果改成car,那么下面的对称点怎么写呢？是不是与rec时是一样的呢？

Originally posted by zxg_far at 2011-01-15 15:33:47:
你写成这个样子试一试
k-points along high symetery lines
40 line-mode
reciprocal
0.0 0.0 0.0
0.5 0.0 0.5

0.5 0.0 0.5
0.5 0.5 0.5

0.5 0.5 0.5
0.5 0.25 0.75

0.5 0.25 0.75
0.375 0.375  ...