[xcrysden] xcrysden & QE
Eric Germaneau
germaneau at gucas.ac.cn
Sat Feb 19 19:33:50 CET 2011
Dear all,
I've installed *XCrySDen 1.5.21* (src-all) and *quantum-espresso (QE)
4.2.1*.
I've spent hours trying to display the output of a molecular dynamics
run (output cp.x from QE package).
When I do a $XCRYSDEN_TOPDIR/scripts/pwo2xsf.sh -ic ./si.out
I get "(standard_in) 1: syntax error".
Do you have any idea about what's going wrong here?
Eric.
--
/Be the change you wish to see in the world
/ --- Mahatma Gandhi ---
Dr. Éric Germaneau <mailto:germaneau at gucas.ac.cn>
College of Physical Sciences
Graduate University of ChineseAcademy of Sciences
Yuquan Road 19A
Beijing 100049
China
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