[Pw_forum] Slow calculation of (5, 5) CNT transmission and complex bands.

chengyu yang chengyu.young at gmail.com
Tue Aug 9 03:53:09 CEST 2011


Hi all.
As an update I calculated the bandstructure assuming that the negative rho
has little effect on the final result, and then I got a bandstructure with a
certain lines in it. I am hoping if anyone can tell me how to get all the k
point for the nscf input, so I can get a more smooth bandstructure finally.
Thank you.

Best regards.

Chengyu Yang
MMAE, University of Central Florida
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