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[abinit-forum] GW full band structure calculation


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  • From: Manuel Pérez Jigato <Manuel.PerezJigato@fys.kuleuven.be>
  • To: forum@abinit.org
  • Subject: [abinit-forum] GW full band structure calculation
  • Date: Mon, 01 Sep 2008 13:36:22 +0200

hi

is there any particular tip/recipe in order to compute a complete band structure
in a solid. At the first sight it does not seem to be an easy task, considering that the examples (the ones i know) in abinit, and the tutorials, explain how to get a specific point in E(k), and that seems? to use the full 3D k-grid, rather than what you would do in a standard LDA band structure, following specific directions/lines.

i would appreciate any information regarding GW complete band-structure calculations.

regards

Manuel Perez Jigato
KU Leuven

Disclaimer: http://www.kuleuven.be/cwis/email_disclaimer.htm



  • [abinit-forum] GW full band structure calculation, Manuel Pérez Jigato, 09/01/2008

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