Author Topic: complex bandstructure  (Read 1863 times)

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Offline ac

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complex bandstructure
« on: February 8, 2012, 07:23 »
Hello,

I was wondering how to analyze the complex bandstructure.

specifically, why dots appear ?  and how sensitive is the calculation to k-points along the different axes ?

thank you.

regards,
Anurag

Offline Anders Blom

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Re: complex bandstructure
« Reply #1 on: February 13, 2012, 13:23 »
The dots are the roots kz to the problem E=E(kx,ky,kz) for a given energy E and k-point (kx,ky). So the closer the energy points, the closer the dots which makes it easier to trace out lines connecting the dots.

There is no k-point sampling for the complex band structure, instead the band structure is computed for a specific value of (kx,ky).