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Help with Spin-Resolved Band Structure in Non-Collinear Case
Date: 2025/02/26 15:51
Name: Md Aktar Hossain   <mdhossainbhu@gmail.com>

Dear OpenMX Community,
I am trying to obtain a spin-resolved band structure for a non-collinear case, as demonstrated in this paper
https://doi.org/10.1103/PhysRevMaterials.7.104005,particularly in Figures 4(a), 4(b), and 4(c). In these plots, the band structure is color-gradient to represent the expectation values of the spin operators sx sy sz
I would greatly appreciate any guidance on how to achieve this within OpenMX.

Thank you in advance for your help!

Best regards,
Aktar
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Re: Help with Spin-Resolved Band Structure in Non-Collinear Case ( No.1 )
Date: 2025/02/27 21:54
Name: Naoya Yamaguchi

Hi,

Please refer to:
https://www.openmx-square.org/openmx_man3.9/node174.html
https://www.openmx-square.org/openmx_man3.9/node178.html
https://www.openmx-square.org/openmx_man3.9/node180.html

Regards,
Naoya Yamaguchi
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