[CPMD-list] about test run

[Ari.P.Seitsonen at iki.fi]

Dear Haibin,

> The platform here is PC-PGI, and the compilor is chosen as
> pgf77. There is no reported errors during compiling.
> Then I tried one test run, the following message is found in the output
> file.
> 
> Will you please tell me your opinion on this ?
> Thank you very much!
> Haibin
> 
> from output
>  INITIALIZATION TIME:                                0.67 SECONDS
>  ***    GMOPTS| THE NEW SIZE OF THE PROGRAM IS   31408 kBYTES ***
>  ZHRWF| RESTART FILE NOT FOUND:                         ./RESTART
> $
>  PROGRAM STOPS IN SUBROUTINE ZHRWF|  FILE NOT FOUND

...

> &CPMD
>   OPTIMIZE GEOMETRY
>   RESTART WAVEFUNCTION COORDINATES
> &END

Did you either rename the file 'RESTART.1' from the first run to
'RESTART'? Or if you don't want to rename it you can use

  RESTART LATEST WAVEFUNCTION COORDINATES

    Greetings,

       apsi

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