[Pw_forum] Band structure of Diamagnetic system

Abolore Musari abmus007 at gmail.com
Fri Jul 20 06:05:01 CEST 2012


Dear Sir,
thank you so much God Bless

On 7/19/12, Paolo Giannozzi <giannozz at democritos.it> wrote:
> On Wed, 2012-07-18 at 16:41 +0100, Abolore Musari wrote:
>
>> shld l also include starting_magnetization in it for fe atom
>> in the system namelist for fes2 diamagnetic semiconductor.
>
> for diamagnnetic semiconductors, it is sufficient to perform
> a calculation without spin polarization
>
> P.
> --
> Paolo Giannozzi, IOM-Democritos and University of Udine, Italy
>
>
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