[xcrysden] error in pwo2xsf.sh in 1.4.1static version

TAE BUM LEE taebumlee at gmail.com
Fri May 22 20:09:08 CEST 2009


Hi,

Does anybody know how to fix the problem of XCrySDen 1.4 static to read
pwscf output file?
When I try to open pwscf ouput in example directory of Quantum-Espresso
tutorial, the error message is generated.

Error: while executing
exec sh
/usr/local/bin/XCrySDen-1.4.1bin-static/scripts/pwo2xsf.sh --optcoor
/home/taebum/Desktop/examples_pwgui/Si.pw.out > pwo2xsf.xsf.

Dr. Kokalj suggest modification of pwo2xsf.sh file with following lines in
mailing list but invalid to me

LANG=C
LC_ALL=C
export LANG LC_ALL

Regards,
TaeBum
########################################

TAE BUM LEE
Dept. Chem. & Biochem
Auburn Univ. AL. 36849
TEL.: 334-844-6912
e-mail: taebumlee at gmail.com
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