fractional number of electrons with HF
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5:25:56 PM PDT - Tue, Jul 15th 2014
This seems to be exactly what I've been looking for. Thank you very much!
So if I write
dft
sic oep
end
task dft
I have a DFT calculation with OEP within KLI approximation. No other xc potential is mixed up to it. Is it correct?