[Pw_forum] q2r.x error

[stefano de gironcoli]

the code was told your file is called $As.matdyn0
and correctly complain because it does not find it

stefano


On 25/09/2015 16:00, Sharad B. Pillai wrote:
> Hello,
>
> I am using 5.1.1 version of espresso
> I performed ph.x calculation and it worked well, but on running q2r.in 
> <http://q2r.in> file, the following error message is displayed
>
> /At line 142 of file q2r.f90 (unit = 5, file = 'stdin')
> Fortran runtime error: End of file
>
>
>
> /
> Following are few lines around line 142 of q2r.f90
>
> IF (ionode) THEN
>      OPEN (unit=1, file=TRIM(fildyn)//'0', status='old', 
> form='formatted', &
>           iostat=ierr)
>      lnogridinfo = ( ierr /= 0 )
>      IF (lnogridinfo) THEN
>         WRITE (stdout,*)
>         WRITE (stdout,*) ' file ',TRIM(fildyn)//'0', ' not found'
>         WRITE (stdout,*) ' reading grid info from input'
>         READ (5, *) nr1, nr2, nr3              
> ...............................line-142
>         READ (5, *) nfile
>      ELSE
>         WRITE (stdout,'(/,4x," reading grid info from file ",a)') &
> TRIM(fildyn)//'0'
>         READ (1, *) nr1, nr2, nr3
>         READ (1, *) nfile
>         CLOSE (unit=1, status='keep')
>      END IF
>   ENDIF
>
>
> Following message is from q2r.out
> file $As.dynmat0 not found
>
> Following is my As.dynmat0 file
>
>    6   6   1
>    20
>    0.000000000000000E+00   0.000000000000000E+00 0.000000000000000E+00
>    0.000000000000000E+00   0.192450089729862E+00 0.000000000000000E+00
>    0.000000000000000E+00   0.384900179459723E+00 0.000000000000000E+00
>    0.000000000000000E+00  -0.577350269189585E+00 0.000000000000000E+00
>    0.166666666666667E+00   0.962250448649308E-01 0.000000000000000E+00
>    0.166666666666667E+00   0.288675134594792E+00 0.000000000000000E+00
>    0.166666666666667E+00   0.481125224324654E+00 0.000000000000000E+00
>    0.166666666666667E+00  -0.481125224324654E+00 0.000000000000000E+00
>    0.166666666666667E+00  -0.288675134594792E+00 0.000000000000000E+00
>    0.166666666666667E+00  -0.962250448649308E-01 0.000000000000000E+00
>    0.333333333333333E+00   0.192450089729862E+00 0.000000000000000E+00
>    0.333333333333333E+00   0.384900179459723E+00 0.000000000000000E+00
>    0.333333333333333E+00   0.577350269189585E+00 0.000000000000000E+00
>    0.333333333333333E+00  -0.384900179459723E+00 0.000000000000000E+00
>    0.333333333333333E+00  -0.192450089729862E+00 0.000000000000000E+00
>    0.333333333333333E+00   0.355761666572514E-16 0.000000000000000E+00
>   -0.500000000000000E+00  -0.288675134594792E+00 0.000000000000000E+00
>   -0.500000000000000E+00  -0.962250448649308E-01 0.000000000000000E+00
>   -0.500000000000000E+00   0.962250448649308E-01 0.000000000000000E+00
>   -0.500000000000000E+00  -0.866025403784377E+00 0.000000000000000E+00
>
>
>
> Plese kindly guide me.
>
> Thanks
>
>
> ...........................................................
> Sharad B. Pillai
> Research Student
> MSU Baroda
> Gujarat
> India
>
>
>
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