[Pw_forum] (no subject)
Gabriele Sclauzero
sclauzer at sissa.it
Tue Dec 22 09:24:25 CET 2009
There have been a request similar to yours some time ago
http://www.democritos.it/pipermail/pw_forum/2008-November/010604.html
you can try to see if it has been solved by following the thread. Most probably, the
problem was caused by your choice of the q-point grid. From the very little information
you provide, it is difficult to say more than this.
Gabriele
yuning wu wrote:
> Dear all,
>
> I am doing a phonon spectrum calculation. After got all *.dyn* files, I
> use the q2r.x to do get *.fc file successfully. However, in phdos
> calculation, I got an error message:
>
> from frc_blk : error # 1
> wrong total_weight
>
> I am confused that what can cause this error. Thanks.
>
> Yuning Wu
>
>
> ------------------------------------------------------------------------
>
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://www.democritos.it/mailman/listinfo/pw_forum
--
o ------------------------------------------------ o
| Gabriele Sclauzero, PhD Student |
| c/o: SISSA & CNR-INFM Democritos, |
| via Beirut 2-4, 34014 Trieste (Italy) |
| email: sclauzer at sissa.it |
| phone: +39 040 3787 511 |
| skype: gurlonotturno |
o ------------------------------------------------ o
More information about the Pw_forum
mailing list