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the calculation of band_gap in the GW approximation including spin_orbit coupling


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  • From: pengyoucool@yahoo.com.cn
  • To: forum@abinit.org
  • Subject: the calculation of band_gap in the GW approximation including spin_orbit coupling
  • Date: Thu, 8 Mar 2007 09:57:49 +0100

Dear users:
I am a new user in abinit. Now I am eager to learn the band_gap
calculation in the GW approximation. The system I pay attention to need to
include the spin_orbit coupling. So I want to know how I should edit the
input file in the foundation of the usual input file. Besides,whether the
pseudopotential file should be modified according to the new code of the
spin_orbit coupling,or not . If the pseudopotential file shoule be
edited,how do that.
I will look forward to your reply.Thank you very much for your
attention.




yours,
Friend



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