[Wien] New Issue with SCF cycle WIEN2k19.2 (was working previously)

Tran, Fabien fabien.tran at tuwien.ac.at
Thu Jun 11 22:58:55 CEST 2020


https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg06444.html?


________________________________
From: Wien <wien-bounces at zeus.theochem.tuwien.ac.at> on behalf of Johnathon Street <jstreet1 at csub.edu>
Sent: Thursday, June 11, 2020 10:45 PM
To: A Mailing list for WIEN2k users
Subject: [Wien] New Issue with SCF cycle WIEN2k19.2 (was working previously)

Dear WIEN users,

I am running WIEN2k19.2. Initially SCF cycle for WIEN2k was running with no issues. I was having an issue running Octave but have got Octave running and SCF cycle now gives message:
hup: Command not found.
STOP  LAPW0 END?
STOP  LAPW1 END?
STOP  LAPW2 END?
STOP  CORE  END?
STOP  MIXER END?
ec cc and fc_conv 0 1 1?
in cycle 2    ETEST: 0   CTEST: 0?
hup: Command not found.

Is this a wrong library issue? Wien2k was built with /opt/OpenBlas but we set the system libblas to the blas installed by the package manager to get octave to work.
Any help is greatly appreciated.

Thank You
Johnathon Street
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