[Pw_forum] Slow calculation of (5, 5) CNT transmission and complex bands.
chengyu.young at gmail.com
Wed Aug 10 17:34:53 CEST 2011
Dear Mr. Sclauzero and all,
It seems nice to me. But in the example 1 ,(in the *Complex band
structures and ballistic conductance* in the hands-on tutorial of quantum
espresso), the pwcond.x comes first, then they gave the nscf script , and
then ran the pw.x and bands.x in following steps.
Is that making any difference from what you said?
Materials Science,University of Central Florida
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