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- From: hu010@sina.com.cn
- To: forum@abinit.org
- Subject: direction of displacement
- Date: Sat, 21 Jun 2003 07:18:46 +0200
Dear sir,
After I have calculated the phonon of BaTiO3 using ABINIT, I used the ANADDB
to get the eigenvectors .The displacement of all atoms are all along only one
cartesian axis in every mode . In the fifteen modes ,the displacement of the
atoms are respectively along y,z,x,z,y,x,y,z,x,z,x,y,z,x,y axis. I think this
is incorrect.Could you please help me.
Best regards,
hu fenglan
- direction of displacement, hu010, 06/21/2003
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