[Wien] error in mBJ
mitra narimani
m.narimani84 at gmail.com
Sun Sep 9 21:51:54 CEST 2018
Hello dear users
I have a problem about mBJ running of monolayer quantum well. I relax my
structure and run it within GGA approach. This process doesnt have any
error and everything goes well. But when I run this monolayer within mBJGGA
approach, in cycles after 8 or 9 the errors occur in lcore with
'CORE' - NSTOP= 362 positive eigenvalue for 4D Atom: 0 La1
'CORE' - Try to apply a potential shift in case.inc
in lcore.error file
and
STOP in MINI, FORCES small
in mini.error file
Please help me to solve these errors.
Best regard.
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