[Wien] Is calculating Knight shifts in semiconductor using WIEN2k feasible?

[林敏]

Dear Prof. Peter Blaha and Prof. Robert Laskowski,

I am Min Lin, a Phd student in Xiamen University. I have a question: Is calculating Knight shifts in semiconductor using WIEN2k feasible?

I am looking for new topic. I had read your publications about calculating Knight shift in metal that implemented in WIEN2k, but not fully understand.  Now I consider the Knight shifts in semiconductor,  when the semiconductor is doped, there is some hole state around the valance band maximum，which is origin of Knight shifts.

Can I get reliable Knight shifts in the system using the method implemented in metal?  Can the  band gap be a  problem?

Looking forward to your suggestions.

Best wishes,

Min Lin

Xiamen University, China.
Email: linmin at stu.xmu.edu.cn <mailto:linmin at stu.xmu.edu.cn> 
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