Hi, I have build QuantumESPRESSO using
QuantumESPRESSO-6.3-foss-2018b.eb %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% task # 0 from write_rhog : error # 1 error opening file /scratch/loris/espresso/tmp-Ir3/Ir.save/charge-density.dat %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% According to this reply to a posting one of my users wrote https://www.mail-archive.com/users@lists.quantum-espresso.org/msg35507.html the program is actually complaining about /scratch/loris/espresso/tmp-Ir3/Ir.save/charge-density.hdf5 which does however exist: $ ll /scratch/loris/espresso/tmp-Ir3/Ir.save/charge-density.hdf5 -rw-r--r-- 1 loris sc 0 Apr 1 16:13 /scratch/loris/espresso/tmp-Ir3/Ir.save/charge-density.hdf5 The suggestion from the mailing list is that there is something wrong with the HDF5 library being used. Can anyone confirm that the Easyconfig is OK or should hdf5 be included in the buildopts? Cheers, Loris -- Dr. Loris Bennett (Mr.) ZEDAT, Freie Universität Berlin Email loris.benn...@fu-berlin.de