[Wien] Error in Parallel HF
Peeyush kumar kamlesh
peeyush.physik.rku at gmail.com
Mon Oct 21 01:20:02 CEST 2019
Sir,
I calculated bandstructure bu using less number of k point with hf
potentials. to calculate other properties I created a new k-mesh by the
procedure given in user guide (page No-55), Then run the following command
and get error in "hf error" file: *Error in Parallel HF*
run_lapw -hf -newklist -i 1 -p
hup: Command not found.
LAPW0 END
LAPW0 END
LAPW1 END
LAPW1 END
LAPW1 END
LAPW1 END
LAPW2 - FERMI; weights written
LAPW2 END
LAPW2 END
LAPW2 END
LAPW2 END
SUMPARA END
CORE END
error in read_cnk: wrong case.vectorhf_old
error in read_cnk: wrong case.vectorhf_old
error in read_cnk: wrong case.vectorhf_old
error in read_cnk: wrong case.vectorhf_old
> stop error
Kindly guide me.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20191021/e49573c6/attachment.html>
More information about the Wien
mailing list