Dear Prasenjit,
it's not implemented yet.
Davide
On 07/12/2012 04:01 AM, Prasenjit Ghosh wrote:
> Dear all,
>
> Has GIPAW been included for calculations using smearing? Some early posts
> says
> that it has not been done.
>
> I want to calculate the nmr spectra of a system which is magnetic and for
> that I
> need to use smearing.
>
> So I was wondering whether in the latest version of QE, GIPAW with occupations
> smearing has been implemented or not.
>
> With regards,
>
> Prasenjit
>
> --
> PRASENJIT GHOSH,
> IISER Pune,
> First floor, Central Tower, Sai Trinity Building
> Garware Circle, Sutarwadi, Pashan
> Pune, Maharashtra 411021, India
>
> Phone: +91 (20) 2590 8203
> Fax: +91 (20) 2589 9790
