[Pw_forum] QE run example 02
Charles Chen
polynmr at physics.unc.edu
Mon May 12 22:54:17 CEST 2008
You sure you have the TMP_DIR correctly set?
what's the error message?
Dong-Hee Lim wrote:
> Dear PWscf users
>
> I was wondering if there was any error in the QE run example 02.
> It is about the frequency calculation.
> Among the calculations shown in the example 02, I could get the same
> results of the scf calculations as shown in the reference data, but I
> can't get any results of phonon calculation at Gamma and at X like as
> following;
>
> phonons of Si at Gamma
> &inputph
> tr2_ph=1.0d-14,
> prefix='si',
> epsil=.true.,
> amass(1)=28.08,
> outdir='$TMP_DIR/',
> fildyn='si.dynG',
> /
>
> 0.0 0.0 0.0
>
what is this line? Do you miss something here?
> Although I have tried many times to get any results from the example
> 02 file, I can't get anything..
>
> I would appreciate if you checked that there was any error in the example 02.
>
> Thank you,
> Dong-Hee Lim
>
>
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>
>
Charles
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