[Wien] How to calculate plasma frequency with Wien2k?.

[ben abdallah houda]

Dear Gavin,
Thank you very much for your response. I will try to follow what you have described above!





________________________________
 De : Gavin Abo <gsabo at crimson.ua.edu>
À : A Mailing list for WIEN2k users <wien at zeus.theochem.tuwien.ac.at> 
Envoyé le : Samedi 16 mars 2013 12h13
Objet : Re: [Wien] How to calculate plasma frequency with Wien2k?.
 

I think you can enter the Drude broadening parameters into case.injoint with option 6 or 7. Then, run x joint to get case.outputjoint with the calculated plasma frequencies.  Refer to section 8.17 and 8.18 in the user guide (http://www.wien2k.at/reg_user/textbooks/usersguide.pdf).  You can also search the mail archive (http://www.wien2k.at/reg_user/mailing_list/) with the keyword "plasma frequency".

On 3/16/2013 4:25 AM, ben abdallah houda wrote:

Dear Wien2k users,
>
>
>I want to ask  about the calculation of the plasma frequency. In fact,  I am trying to calculate the magneto-optical properties, why I introduced the spin-orbit coupling in my calculations and I will then calculate the optical conductivity. Since my crystal is likely half-mettalic, I must take into account intra-band transitions, for that I have to calculate the Drude term which contains the plasma frequency. I know the Drude formula, but my question is how from the WIEN2k code I can get the value of this frequency?
>
> Any answer can help me.
>Thank you for your cooperation
>
>
>Dr. Houda Ben Abdallah
>Faculty of Science. Physics departement. 
>Condensed Matter Laboratory (LPMC)
>Tunis. TUNISIA
>

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