[Pw_forum] carbon nanotube & copper chain

chengyu yang chengyu.young at gmail.com
Fri Jun 18 03:39:24 CEST 2010


Dear Wang,
     1,  I don't know where to find the Cu.pz-vbc.UPF, I just download the
pseudo from the web, in which no Cu's norm pseudopotential at all.
     2, what do you mean by 1 1 X? There are only 3 parameters for K points?
I am new to quantum espresso, and really don't know how to choose the right
k points.  Thank you.

Chengyu Yang
Graduate student
Materials Science & Engineering


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