[Pw_forum] problem restarting calculation with hybrid-ultrasoft pseudo potential using QE 5.2

Behnaz Bagheri behnaz.bagheri15 at gmail.com
Tue Aug 4 10:31:42 CEST 2015


Dear all,

I am using the new version of QE 5.2 and I am running a "relax" calculation
with hybrid xc and ultrasoft pseudo potential. The problem is I  cannot
restart the calculation since It doesn't produce me an *.xml file in the
output directory. I don't know what is the reason for it. Can anybody help
me with it?

Best,
Behnaz

--------------------------
Behnaz Bagheri
PhD Candidate
Department of Mathematics and Computer Science
<https://www.tue.nl/en/university/departments/mathematics-and-computer-science/the-department/staff/>
Centre for Analysis, Scientific Computing, and Applications W&I
<https://www.tue.nl/en/university/departments/mathematics-and-computer-science/the-department/staff/by-sub-department/ep-tab/1974/>
Technische Universiteit Eindhoven
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