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[abinit-forum] LDA ground state of piezoelectric material

From: Manuel Pérez Jigato <Manuel.PerezJigato@fys.kuleuven.be>
To: forum@abinit.org
Subject: [abinit-forum] LDA ground state of piezoelectric material
Date: Wed, 14 May 2008 21:46:31 +0200

hi

when calculating the LDA ground state of a piezo, or some other polar solid, how
do you tell ABINIT to correct for the electric field at Gamma.
I guess this option exists not only for response-piezoelectric-tensor calculations.

thanks

Manuel Perez Jigato

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[abinit-forum] LDA ground state of piezoelectric material, Manuel Pérez Jigato, 05/14/2008