[Pw_forum] regarding total energy

[Paolo Giannozzi]

On Tue, 2014-03-04 at 10:59 +0530, himanshu at iopb.res.in wrote:

> I am looking for total energy value at particular k-point.

there is no such thing as "the total energy value at particular
k-point"

P.

>  In the output file of SCF calculation, total
> energy and its different contribution is mentioned . Can
> I get similar information for particular k-point .
> 
>                  Thanks for benign help in advance.
> Regards
> Himanshu
> I.O.P
> 
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-- 
Paolo Giannozzi, Dept. Chemistry&Physics&Environment, 
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222