[Pw_forum] how to obtain the 2-D charge density ?

an peng wenpengan at gmail.com
Fri May 19 15:01:06 CEST 2006


yes, I know I should  read example05, but  I cannot plot the 2-D charge
density with pp_rho.out.



cat > naalh4.chdens.in << EOF
 &input
    nfile = 1,
    filepp(1) = 'naalh4charge',
    weight(1) =1,
    iflag = 2,
    plot_out = 1,
    output_format =1,
    fileout = naalh4.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

  could anyone tell me what is wrong with the shell.

 thanks!
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