[Pw_forum] LDA+U with phonon

Sanjeev Gupta physics.skgupta at gmail.com
Fri Apr 20 13:48:24 CEST 2012


Dear PWSCF users.

I would like to know the present status of use LDA+U in phonon calculation.
Further, the problem in rare-earth materials due to f-electron need
justification, how we overcome this issue in phonon calculations?

Please suggest me.
Best Regards
Sanjeev

-- 
*Dr. Sanjeev Kumar Gupta*
*Post Doctoral Fellow,
(Ministry of New and Renewable Energy)
Department of Physics,
Bhavnagar University, Bhavnagar-364 022
Gujarat, India*
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