[Wien] Ueff

[karima Physique]

Dear prof. P. Blaha and wien2k users :

I am still waiting for your answers and I thank you in advance.

my question was :

Does Ueff=U-J or Ueff=U- 1/2 J? how to estimate J using constrained DFT.?

Thank you in advance


2017-11-27 12:05 GMT+01:00 karima Physique <physique.karima at gmail.com>:

> Dear Wien2k users:
>
> Does Ueff=U-J or Ueff=U- 1/2 J? how to estimate J using constrained DFT.?
>
> Thank you in advance
>
>
>
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