[Pw_forum] charge density difference
ÇÍÓÇä ÚÑíÞÇÊ
ihsanas at yahoo.com
Sat Jul 28 15:52:37 CEST 2007
Dear pwscf users
I am trying to plot charge density difference (using
version 3.2).I can made IrO.charge ,Irclean .charge
and O.charge but when I tried to make charge density
difference ,I have error my file is as shown below
&inputpp
/
&plot
nfile = 3
filepp(1) = 'IrO.charge'
filepp(2) ='Irclean.charge'
filepp(3) ='O.charge'
weight(1) = 1.0
weight(2) = -1.0
weight(3) = -1.0
iflag = 2
output_format = 2
fileout = '1x1charge.rho.dat'
e1(1) =0.0, e1(2)=0.0, e1(3) = 1.0,
e2(1) =1.0, e2(2)=1.0, e2(3) = 0.0,
nx=60, ny=64
/
The error
forrtl: severe (174): SIGSEGV, segmentation fault
occurred
Image PC Routine Line
Source
pp.x 082634E0 Unknown
Unknown Unknown
pp.x 0826029A Unknown
Unknown Unknown
pp.x 08239EE5 Unknown
Unknown Unknown
pp.x 0823970C Unknown
Unknown Unknown
pp.x 0806F2E1 Unknown
Unknown Unknown
pp.x 0804B06D Unknown
Unknown Unknown
pp.x 08049B4B Unknown
Unknown Unknown
pp.x 08049AC6 Unknown
Unknown Unknown
libc.so.6 001267E4 Unknown
Unknown Unknown
pp.x 08049A01 Unknown
Unknown Unknown
Can someone help me
regards
Ihsan
physics department
Jordan
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