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The newest pp pseudodojo pp can support spin orbital coupling
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Topic: The newest pp pseudodojo pp can support spin orbital coupling (Read 4378 times)
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njuxyh
QuantumATK Guru
Posts: 163
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The newest pp pseudodojo pp can support spin orbital coupling
«
on:
February 9, 2019, 10:29 »
Hi :
i want to see the band split due to the soc, and i am wondering the pseudoDojo pp can support this kind calculation?
thanks very much
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Daniele Stradi
Supreme QuantumATK Wizard
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Re: The newest pp pseudodojo pp can support spin orbital coupling
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Reply #1 on:
February 11, 2019, 08:58 »
Hi.
No, only OMX and SG15 support spin-orbit coupling in QuantumATK-2018-SP1-1.
Best regards,
Daniele
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Anders Blom
QuantumATK Staff
Supreme QuantumATK Wizard
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Re: The newest pp pseudodojo pp can support spin orbital coupling
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Reply #2 on:
March 25, 2019, 22:53 »
2019.03 does support SOC for the PseudoDojo GGA PPs
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The newest pp pseudodojo pp can support spin orbital coupling