PZ-SIC
Xiaoming Wang
wxia... at gmail.com
Mon Jan 1 01:22:18 UTC 2018
Hello,
Can anyone comment on the PZ-SIC method (not the scaled PZ) implemented in
CP2K? I used the following setup to do PZ-SIC calculation on all the
orbitals, but the calculation got stuck at the very beginning. There is no
error report cause the monitor shows the job is still running.
...
LSD
&SIC
ORBITAL_SET ALL
SIC_METHOD EXPLICIT_ORBITALS
&END SIC
...
Best,
Xiaoming
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