[Pw_forum] EFFECTIVE MASS FROM BAND STRUCTURE

[Giovanni Cantele]

Please try to better explain your question. The output k-points are always just what you specify in your input. Do you need to know how to set up k-point path in a band structure calculation? Units are unimportant, provided
that, for a given choice of the units, you specify the right coordinates of the k-points you need.

Giovanni

> On 9 Jun 2017, at 17:43, Praise Olutuase <praise.olutuase at gmail.com> wrote:
> 
> Dear all,
> 
> How do I ensure that the exact k-points in the input at the same that are outputed with their energy values in a band structure calculation. Especially if the inputed K-points are in crystal coordinates. Thanks
> 
> Best Regards,
> Praise,
> Post Graduate Student, 
> University of Ibadan, Nigeria.
> 
> Sent from my iPhone
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-- 

Giovanni Cantele, PhD
CNR-SPIN
c/o Dipartimento di Fisica
Universita' di Napoli "Federico II"
Complesso Universitario M. S. Angelo - Ed. 6
Via Cintia, I-80126, Napoli, Italy
e-mail: giovanni.cantele at spin.cnr.it
Phone: +39 081 676910
Skype contact: giocan74

ResearcherID: http://www.researcherid.com/rid/A-1951-2009
Web page: http://people.fisica.unina.it/~cantele

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