[Wannier] Tutorial about Wannier90 with the interface of VASP

[szaboa]

Dear Ming,
I wrote a small step-by-step tutorial on how to generate the Wannier 
functions of single-layer MoS2 using VASP and Wannier90.
You can download it from here: 
https://iis.ee.ethz.ch/~szaboa/MoS2_Wannier_tutorial.zip
The first few steps you might find useful if you are not familiar with 
VASP (ionic relaxation, band structure calculation). It also includes a 
Matlab script that helps visualizing the character of each state with 
respect to the atomic orbitals if you calculated the s,p,d -projections 
of the wavefunction with VASP. It helps in selecting the initial 
projections for the Wannier transformation.
The very last step explains how to create the Hamiltonian of a 
finite-sized device. You probably won't need it, unless you want to do a 
self-consistent transport simulation.

Best,
Aron

On 2015-11-15 08:39, Ming Yang wrote:
> Dear All,
>
> I just start learning wannier90, and the code I use often is VASP.
>
> Might I ask your help to recommend some more hand-on tutorials of
> wannier90 interfacing with VASP? I know some examples of using
> wannier90 on VASP official website, but still need more examples.
>
> Thank you.
>
> Best regards,
>
> Ming Yang
>
> _________
>
> Department of Physics,
>
> National University of Singapore
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