[Pw_forum] gap from DOS and bandstructure
Gabriele Sclauzero
sclauzer at sissa.it
Thu Jun 11 10:03:47 CEST 2009
Mansoureh Pashangpour wrote:
> Dear all
> I have calculated DOS and Bandstructure for a system.
> I expect to find similar gap from two runs.
> But they have 0.4 eV difference with each other. What is the root of
> this differenc?
Maybe the gap is not at the k-point where you expected it to be? Maybe something else...
how to guess with such a little of information on your system (as well as about your
affiliation).
GS
> Thanks
> Pashangpour
>
>
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| Gabriele Sclauzero, PhD Student |
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