[Pw_forum] Quantum Espresso Lab using cp.x

[s305igun at mail.chem.itb.ac.id]

Dear all,

I have problem when I run some example from examples_cp (Quantum Espresso
Lab using cp.x v.5). The problem is cppp.x, and output report give
comment:

########################################################################################################################
# UNRECOVERABLE ERROR (ierr=1)
# ERROR IN: iotk_open_read (iotk_files.spp:479)
# CVS Revision: 1.2
# unit
file=.//h2o_mol_51.save/data-file.xml
binary=F
iostat=29
########################################################################################################################

Do the people can help this problem?

Thanks verry much

Good luck for your research

Rahmat Gunawan
PhD Student
Lab. Theoretical and Computational Chemistry
Department of Chemistry
Institut Teknologi Bandung
West Java
Indonesia