[Pw_forum] magnetic anisotropy calculation using fully-relativistic PPs

[Peter Cybertron]

Thank you for your suggestion, I will first try a smaller beta.

Yun-Peng

On 09/11/2015 05:00 PM, Youssef wrote:
> Dear Yun-Peng,
>
> Generally non-collinear calculation is hardest to converge, but I 
> can't figure it out without knowing your physical system nor without a 
> complete scf file.
>
> But firstly,  you should reduce your mixing factor instead of increase 
> it , start with   mixing_beta = 0.1 and compare.
>
> Youssef Aharbil,
> Laboratory of Physics and Chemistry of Materials
> Faculty of sciences Ben msik, Casablanca
> Morocco
>
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