Hi all,
I tried to build a parallel version of siesta 3 on our team's cluster. The
siesta version is siesta-3.0-rc2.
It compiles fine but when I run the automate tests, I am getting the
following error for all the tests:
>>>> Running sih test...
==> Copying pseudopotential file for Si...
==> Copying pseudopotential file for H...
==> Running SIESTA as /home/jingbli/SIESTA/Obj/siesta
ERROR(FoX)
Invalid Element Name atom
Searching the archieve threads, I saw an email from Albertoto suggest
disabling XML output in fdf with "WriteXML F", After setting this option in
the fdf file, I did see the test finish. Just wondering anybody else has
other workaround to get XML result, so we can use xml differencer.
Thanks,
Jingbin
