[Pw_forum] The inputs of "ph.x"

潘登 panda.deng.pan at gmail.com
Tue Feb 24 06:49:14 CET 2009


Dear All Users,

When I was try to running a phonon calculation,I have got this error message.

     from phq_readin : error #         1
     reading inputph namelist

Although I know I have some mistake in the inputs,I don't know which
is.Here is the inputs of mine.

 &inputph
  tr2_ph=1.0d-10,
  prefix='BaNiAs',
  amass(1)=56.00,
  amass(2)=28.00,
  amass(3)=33.00,
  outdir='/disk2/xgwan/tmp/'
  fildyn='BaNiAs.dyn',
  ldisp=.true.,
  nq1=8, nq2=8, nq3=8
 /


Perhaps the error  is the missing of "xq(1)xq(2)xq(3)".But it not
specified in the example06 either. If that is the problem, Please
someone tell me how to set the value of these.

Have nice day!

Pan Deng
Nanjing University



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