Dear All,
I'm trying to calculate the charge density difference between the same
structure with and without the hubbard correction term. I have calculated
already the charge density for the two structure.
The input file for getting the difference is :
&inputpp
/
&plot
iflag = 3 ,
nfile = 2 ,
filepp(1) = 'slub_no_hubb.charge' ,weight(1) = -1.0
filepp(2) = 'slub_hubb.charge' , weight(2) = 1.0
output_format =3 ,
nx = 100 ,
ny = 100 ,
nz = 100 ,
fileout= 'cdd.dat' ,
/
and the error is :
Serial version
Reading header from file slub_no_hubb.charge
At line 119 of file plot_io.f90 (unit = 4, file = 'slub_no_hubb.charge')
Fortran runtime error: Bad integer for item 1 in list input
Anynone may help me ?
Best regards
Luca Maggi
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