[Pw_forum] from matdyn : error # 49

[GAO Zhe]

Please modify flfrc line from flfrc = Al4.fc to flfrc = 'Al4.fc' ~~~~ It is a small careless mistake~

--
GAO Zhe
CMC Lab, MSE, SNU, Seoul, S.Korea




At 2011-07-13 22:47:39，"Guntram Schmidt" <guntram.schmidt at chemie.uni-halle.de> wrote:

>Dear All,
>
>I'm trying to get QHA working on our clusters.
>When I try to run the first example (Al), I get the above error.
>I don't know this matdyn - here is the corresponding input-file, created 
>by Run_Me:
>
>
>&input
>     amass(1)=26.98,
>     asr='crystal',
>     flfrc=Al4.fc,
>     flfrq='frequency'
>&end
>  455
>        .50000    .50000    .00000   1.00000
>...
>...
>...
>        .50000    .04167    .04167   1.00000
>        .50000    .00000    .00000   1.00000
>EOF
>
>
>The error message is:
>
>%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>    0:     from matdyn : error #        49
>    0:     reading input namelist
>    0: 
>%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>    0:
>    0:     stopping ...
>
>
>I had to start it via our mpi-loadleveler - which shouldn't affect this 
>errors, imho.
>
>Any ideas on this?
>Thanks,
>Guntram
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