[Pw_forum] File Error of GIPAW module
Bingwen Hu
bw.hu at yahoo.com
Mon Mar 1 15:43:48 CET 2010
Dear All,
I used gipaw to calculate the NMR information and I got
an error:
----------------------------------------------------------------------------------------------
At line 174 of file paw_gipaw.f90 (unit = 14, file = '')
Fortran
runtime error: File '' does not exist
----------------------------------------------------------------------------------------------
I have succeeded in running the pw.x.
The input file for GIPAW is
shown below:
----------------------------------------------------------------------------------------------
&inputgipaw
job = 'nmr'
prefix = 'pwscf'
tmp_dir =
'/home/bingwen/espresso-4.1.2/PWgui-4.1.1/TMP/'
iverbosity = 1
q_gipaw = 0.01
spline_ps = .true.
use_nmr_macroscopic_shape = .true.
/
----------------------------------------------------------------------------------------------
Thank you in advance for your help.
Best
Bingwen
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