Open anhph opened 6 years ago
Hi Anh
To your question, yes, it can deal with the noncolinear WAVECAR.
In order for the code to better recognize the WAVECAR, please add the "lsorbit" argument
unfold(M=M, wavecar='WAVECAR', lsorbit=True)
Best
On Mon, Jul 30, 2018 at 8:52 PM, anhph notifications@github.com wrote:
Hi.
Is it possible to unfold the band structure with spinor wavefunction like including spin-orbit coupling in VASP ? I tried this with your code but i got the error "Number of planewaves not consistent"
Thanks, Anh
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Hi.
Is it possible to unfold the band structure with spinor wavefunction like including spin-orbit coupling in VASP ? I tried this with your code but i got the error "Number of planewaves not consistent"
Thanks, Anh