Hello all,<div><br /></div><div>I have the following question: say that I first do a high spin calculation using the attached input screen (MULTIPLICITY=13). Is there a straightforward way to flip the spin on half of the Cu atoms, and use that as a initial guess for a subsequent low spin (MULTIPLICITY=1) calculation?</div><div><br /></div><div>Thanks,</div><div>Vincent</div>

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