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Re: [abinit-forum] problem PAW densitiy file processing (den -> xsf) with cut3d


Chronological Thread 
  • From: Matthieu Verstraete <mjv500@york.ac.uk>
  • To: forum@abinit.org
  • Subject: Re: [abinit-forum] problem PAW densitiy file processing (den -> xsf) with cut3d
  • Date: Wed, 18 Oct 2006 11:01:24 +0100 (BST)


This is a format problem in cut3d: as you can see there are no white spaces and the format is not long enough for the floating point numbers.

Pierre-Matthieu is correct, but from the 4.6.5 source the format strings look ok, and they have spaces in it. Are you sure you're not using an older version of cut3d? If not, send me (just me) the full header+ a few lines of density, and eventually the _DEN file if it isn't too big (less than 2MB).

Matthieu

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Dr. Matthieu Verstraete mailto:mjv500@york.ac.uk
Dept. of Physics, University of York, tel: +44 1904 43 22 08
Heslington, YO10 5DD York, United Kingdom fax: +44 1904 43 22 14



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