[Wien] Component of spin polarization

[Md. Fhokrul Islam]

Hi Prof Blaha and Wien2k users,

I am interested in calculating expectation values of different components of spin operator for a given quantization direction for a surface calculation. More specifically, if I set quantization along some in-plane direction, say along x-axis (in case.inso file), how can I obtain the expectation value of out-of-plane component <Sz> from Wien2k calculations? Is it saved in some output file?


Thanks,
Fhokrul
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