On Thu, Jul 7, 2016 at 1:34 PM, Giovanni Cantele <[email protected]> wrote:
> The “417” could be understood (...) saying that because I’m using 10 pools and > 417 ~ 4161 / 10, the section "Computing kpt #:” is printed only by the first > pool correct (I mean: your statement, not the behavior of the code which is not correct!) > The 1431 is instead more difficult to understand. there might be a minus sign where you assume a blank. Try for instance grep -e ". k = " -e ". k =-"MYOUTPUT | wc > Last question: If in this case I would like not to repeat the calculation, > apart from writing a script to read all the K*/eigenval.xml, is there any > other way to get all the already computed eigenvalues to compute the DOS? Unfortunately there is currently no other way. In the next version, the eigenvalues will be written in the same file and no longer in 4161 different files Paolo -- Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche, Univ. Udine, via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222 _______________________________________________ Pw_forum mailing list [email protected] http://pwscf.org/mailman/listinfo/pw_forum
