Dear all,
I want to know the orbital moment part for certain state for the spin-orbit calculations. Can we do that ?
If my understanding is correct, in the PROCAR, mx, my, mz component is also written. Then, are the number corresponds to the total angular momentum? I mean, orbital angular moment + spin angular moment?
I already know that the LORBMOM tag generates orbital moment component for each atom to the OUTCAR, but what I want to know is that can we do the same thing for the PROCAR file whithin LORBIT=11 ?
Thank you.
Kim.
<span class='smallblacktext'>[ Edited ]</span>
Orbital angular momentum & Spin angular moment for PROCAR
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HJ.Kim
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Orbital angular momentum & Spin angular moment for PROCAR
Last edited by HJ.Kim on Fri Dec 13, 2013 1:08 am, edited 1 time in total.
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support_vasp
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Re: Orbital angular momentum & Spin angular moment for PROCAR
Hi,
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