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cut3d and Xcrysden


Chronological Thread 
  • From: chen.dong@nims.go.jp
  • To: forum@abinit.org
  • Subject: cut3d and Xcrysden
  • Date: Tue, 8 May 2007 11:23:38 +0200

Dear all:

Here I have a question ( or a problem?).

I am using ABINIT for the electronic structure analysis. I want to see the
nature of each state in the band structure, and tried to draw pictures of the
wavefunctions. The 3D data were made with 'cut3d' and the pictures were
obtained with 'Xcrysden', although only the real part of the wavefunction was
visualized. But, the obtained picture of the wavefunction is PERIODIC even
for the off-Gamma point !!

Do you have any idea about this or do you have any person who knows much
about this?

Best wishes,
Chen




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