[Pw_forum] sicharge
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ihsanas at yahoo.com
Tue Feb 6 17:12:46 CET 2007
Dear all
I am trying to run example 5 ,when I run pp.x ,It make
sicharge ,but it did`t Read data from file sicharge
and did`t Write data to be plotted to file si.rho.dat.
I don`t know what`s wrong.I`m sending input file and
output .
&inputpp
prefix = 'si'
outdir = '/root/espresso-exc/tmp/'
filplot = 'sicharge'
plot_num= 0,
/
&PLOT
nfile = 1,
filepp(1) = 'sicharge',
weight(1) = 1.0,
iflag = 2,
output_format = 3,
fileout = 'si.rho.dat',
e1(1) =1.0, e1(2)=1.0, e1(3) = 0.0,
e2(1) =0.0, e2(2)=0.0, e2(3) = 1.0,
nx=56, ny=40
and it is output is
Program POST-PROC v.2.1.2 starts ...
Today is 6Feb2007 at 5:41:12
Reading file si.save ...
read complete
Reading file si.save ...
read complete
nbndx = 4 nbnd = 4 natomwfc = 8
npwx = 350
nelec = 8.00 nkb = 8 ngl = 65
Calling punch_plot, plot_num = 0
Writing data on file sicharge
please help me .
Ihsan
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