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SO along with LSDA+U
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Topic: SO along with LSDA+U (Read 2619 times)
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ramkrishna
Supreme QuantumATK Wizard
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SO along with LSDA+U
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on:
April 23, 2016, 08:46 »
Dear Sir,
Is it possible to consider spin-oribit coupling (SO) along with LSDA+U in ATK 2015.1?
Thanks
Ramkrishna
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Jess Wellendorff
QuantumATK Staff
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Re: SO along with LSDA+U
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Reply #1 on:
April 25, 2016, 08:46 »
No, DFT+U doe snot work with non-collinear spin, and therefore also not with spin-orbit.
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