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Re: Re: Re: [abinit-forum] convergence problen in RF calculation

From: zmq.lyao@gmail.com
To: forum@abinit.org
Subject: Re: Re: Re: [abinit-forum] convergence problen in RF calculation
Date: Mon, 17 Apr 2006 08:28:26 +0200

Thanks for your advice.
The Sr pseudo I used is from the Troullier-Martins psp which treats the
valence of Sr as 8. The ecut=40 is based on my convergence test of GS
calculation. According to your suggestion, I shall try higher ecut.

best regard.
Zeming

Re: [abinit-forum] convergence problen in RF calculation, Yanqing Zheng, 04/15/2006
- <Possible follow-up(s)>
- Re: Re: [abinit-forum] convergence problen in RF calculation, mmikami, 04/16/2006
- Re: Re: Re: [abinit-forum] convergence problen in RF calculation, zmq . lyao, 04/17/2006
- Re: [abinit-forum] convergence problen in RF calculation, Masayoshi Mikami, 04/18/2006
  - Re: [abinit-forum] convergence problen in RF calculation, Masayoshi Mikami, 04/18/2006