[Wannier] CoSi2 wannier

[KuangChung Wang]

I am not sure if I can post a png and a text file directly. Let me try. [image:
Inline image 1]

On Fri, Feb 12, 2016 at 9:06 PM, Jesse Vaitkus <jesse.vaitkus at rmit.edu.au>
wrote:

> Hello Kuang,
>
> unfortunately not much can be done without a little bit more information,
> could you post an image of the bands you list to project?
>
> This will help us know if disentanglement is needed.
>
> It is also preferable if you provide the re rest of your .win file.
>
> Otherwise general advice is to make sure that your system is well
> converged before wannierisation with a suitable number of k points.
>
> Cheers,
> Jesse Vaitkus
> On 13/02/2016 12:51 pm, "KuangChung Wang" <kevin60105 at gmail.com> wrote:
>
>> Dear wannier community:
>>
>> I am trying to work on CoSi2. Using the initial projection as shown.
>> However, the spreading is still quite large. Wonder if there are good
>> suggestions on how to choose the projections. Or if the disentanglement is
>> needed in this case. Thank you.
>>
>>   Begin Projections
>>
>>   Co:sp3;l=2
>>
>>   Si:sp3
>>
>>   End Projections
>>
>> --
>> Sincerely,
>> Kuang Wang
>> Ph.D. Student||Electrical Engineering | Purdue U.
>>
>>
>> _______________________________________________
>> Wannier mailing list
>> Wannier at quantum-espresso.org
>> http://mailman.qe-forge.org/cgi-bin/mailman/listinfo/wannier
>>
>>


-- 
Sincerely,
Kuang-Chung Wang
Ph.D. Student||Electrical Engineering | Purdue U.
M.S. EE | NTU & UC Santa Barbara
B.S. Electrical Engineering| Nation Taiwan University
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