Re: Mulliken spin for CASSCF

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Posted by Steven on June 16, 2014 at 15:24:34:

In Reply to: Re: Mulliken spin for CASSCF posted by Mihai Surducan on April 14, 2014 at 15:23:00:

: Thank you for your reply, Steve. Should it be 0 even if the highest weight CSF seems to be a broken symmetry solution?

How can a CSF correspond to a broken symmetry solution? That doesn't make sense to me.




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if B is 1s22s22p1, what is Li?

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