[Wannier] How could I use wannier90 for surface structure? Is there any research or examples?

Seo, Seung-Woo ironmask32 at gmail.com
Thu Jan 24 14:53:53 CET 2019


Dear Wannier90 users and contributors,

Could you let me know how to use wannier90 to surface, slab, and interface?

I wonder even it is possible because the wannier function is based on bloch
wave. I think it is gonna lose reliablity.

Moreover, I tried to use wannier90 with vasp to fccCu 100 slab with 3
layers but it does not work.

There is no examples about surface, so, it is welcome to give me the
information about the research and examples about surface structure using
wannier90.

Thank you very much!

Best Regards,

Eric

-- 
Seo, Seung-Woo

Ph. D

Research Staff Member

Computer Aided Engineering group (CAE)

Platform Technology Lab.

Samsung Advanced Institute of Technology (SAIT)

Samsung Electronics. Inc.

+82-10-2487-1683
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/wannier/attachments/20190124/80f87845/attachment.html>


More information about the Wannier mailing list