[xcrysden] Error on viewing structure

Harry Gotsis hgotsis67 at yahoo.com
Wed Apr 17 20:42:29 CEST 2013


Dear All;

I'm trying to verify the geometry of a CRYSTAL09 input file (see
attached file) using XCrySDen. However, when I click the 'View Slab'
button on the Open Crystal Input window, I get an ERROR with the
following ErrorInfo:

At line 611 of file gengeom.f (unit = 34, file = 'fort.34')
Fortran runtime error: Bad integer for item 1 in list input

Thank you, looking forward to your answer at your earliest convenience.

Best Regards,
Harry Gotsis
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