[Pw_forum] not able to visualize the optimized coordinate of the output file with xcrysden

vicky singh kirtinandan07 at gmail.com
Wed Feb 16 10:38:57 CET 2011


Dear friends
I want to visualize the optimized coordinate or latest coordinate of the
output file for pw.x with xcrysden but it gives an error.

For optimized coordinate error is
ERROR: While executing exec sh
/home/XCrySDen-1.4.1bin-static/scripts/pwo2xsf.sh -optcoor

for latest coordinate the error is
Error: ERROR: wrong number of fields (6) in atomic coordinates, should be 4
or 7.

Thanks in advance

vicky singh
research student Bangalore
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