[Wannier] SHC of 1T'-MoS2

[Vahid Askarpour]

Dear Wannier Users,

Since there has been no response to my initial post, does anyone know if the postw90 code has been benchmarked for SHC?

Thanks,
Vahid

On Aug 24, 2025, at 3:55 PM, Vahid Askarpour <vh261281 at dal.ca> wrote:

Dear Wannier Users,

In Scientific Reports (2025) 15:16354, the SHC of 1T’-MoS2 is calculated in Fig 4a and reaches a maximum of e^2/h at the Fermi level. I calculated the SHC of this material with Wannier90/Postw90 codes. The input files and the Fermi scan (Fermi energy=-2.474eV) are attached. I get 0.05e^2/h at the Fermi level. I am not sure if the published data are incorrect, if there is a bug in the postw90 code or if I am missing something in my input. I would appreciate any input you might have on the source of this discrepancy.

Thank you,
Vahid

Vahid Askarpour
Department of Physics and Atmospheric Science
Dalhousie University
Halifax, Canada

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