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Wanghui6383

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Originally posted by Wanghui6383 at 2009-4-10 20:58:


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Wanghui6383(½ð±Ò+2,VIP+0):ÀÖÓÚ°ïÖú¡£Ð»Ð»ÌÖÂÛ 4-12 13:35
Ask:


  Quote:
I want to plot Band structure by use
Case.Spaghetti_ene file but I don't know, what are the five columns in this
file? Could you please let me know, how can I plot Band structure by
Case.Spaghrtti_ene file and or other files?



Answer


  Quote:
The first three columns correspond to coordinates of the particular k-point,
the 4th column is the total distance of your path in the k-space, and the
last column is the actual energy corresponding to this k-point and energy
band. Bands are listed below each other.

To plot the band structure you need only the 4th and 5th columns. The first
three are there mainly for you orientation and to allow you to label
important points in your band structure correctly.
6Â¥2009-04-10 21:58:36
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