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Use of band2eps


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  • From: sederenzo@lbl.gov
  • To: forum@abinit.org
  • Subject: Use of band2eps
  • Date: Wed, 7 Sep 2005 07:32:32 +0200


To gain experience with band2eps, I added "eivec2 4" directly after "band2 8"
in the file t35.in in the ABINIT/Tutorial/Work3 directory and ran
../../abinis <t35.files >&t35.log

which generated the output files
t35.out, t35.log, t35o_DS2_WFK, t35o_DS1_WFK, t35o_DS1_DEN, and t35o_DS1_DDB.

Note that t35i and t35o were not created.

I then ran
../../band2eps <t35.files >&t35.band2eps.log

No eps file was created and the t35.band2eps.log file contained:

Opening file t35.out

Opening file t35i

Opening file t35o

Opening file t35.in


? FORTRAN Runtime Error:
? Illegal character in numeric input
? READ(UNIT=21,...

Clearly band2eps is unhappy. Please tell me what I am doing wrong,

Thanks
Stephen Derenzo








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