[xcrysden] Re: XCrySDen Viewing of External format data of CRYSTAL03/98

Tone Kokalj xcrysden@democritos.it
Mon, 27 Mar 2006 16:54:10 +0200


This is a multi-part message in MIME format.
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M. K. Singh wrote:

>Dear All,
>I would like to visualise CRYSTAL03/98 input with keyword EXTERNAL. The
>corresponding fort.34 file for EXTERNAL format is available in the same
>directory where input file exit but I can’t visualise it using Xcrysden
>code.
>Any help will be highly appreciated.
>  
>

Indeed, the parsing of crystal03 input files with "EXTERNAL" keyword
is not supported (I never thought about that). However the fix was quite
simple. I attach the tar-gzipped file of four patched Tcl files. Please 
put them in
$XCRYSDEN_TOPDIR/Tcl.

Then the "EXTERNAL" feature should work.

Regards, Tone

--------------010408070001000809040203
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