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[Fwd: Re: [abinit-forum] generate the GW band structure]


Chronological Thread 
  • From: "D. R. Hamann" <drhamann@mat-simresearch.com>
  • To: forum@abinit.org
  • Subject: [Fwd: Re: [abinit-forum] generate the GW band structure]
  • Date: Fri, 06 Feb 2009 09:15:53 -0500



-------- Original Message --------
Subject: Re: [abinit-forum] generate the GW band structure
Date: Fri, 06 Feb 2009 09:14:03 -0500
From: D. R. Hamann <drhamann@mat-simresearch.com>
To: yelinhui@hotmail.com
References: <sympa.1233887840.2684.463@abinit.org>


Dear Linhui,

For documentation of the methods, see D. R. Hamann and D. Vanderbilt, Phys. Rev. B 79, 045109 (2009).  An example with reasonably good notes in 5.7.2 is tests/wannier90/Input/t03.in.  Also see the README, and be sure to go through the wannier90 tutorial (LDA-based) first.

Don Hamann

yelinhui@hotmail.com wrote:
Thanks for the reply. Is there any document on how to do this? Or maybe an
example input?

Linhui

  

-- 
D. R. Hamann
Mat-Sim Research LLC    | Department of Physics
P.O. Box 742            |  and Astronomy
Murray Hill, NJ 07974   | Rutgers University
phone: 908-370-8079     | 732-445-5500, x4381

email: drhamann@mat-simresearch.com


-- 
D. R. Hamann
Mat-Sim Research LLC    | Department of Physics
P.O. Box 742            |  and Astronomy
Murray Hill, NJ 07974   | Rutgers University
phone: 908-370-8079     | 732-445-5500, x4381

email: drhamann@mat-simresearch.com




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