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Re: [abinit-forum] How to set the rprim of the base-centered orthorhombic lattice(space group 36)?


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  • From: "Anglade Pierre-Matthieu" <anglade@gmail.com>
  • To: forum@abinit.org
  • Subject: Re: [abinit-forum] How to set the rprim of the base-centered orthorhombic lattice(space group 36)?
  • Date: Sun, 22 Jul 2007 09:53:12 +0200
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Hi Rain Man (:-)

What are the values of acell you use ?
From the rprim I think you may actually give a BCorthorombic. However, I think, it depends on the chosen value for acell. Are you sure you have a/=b/=c ?

Regards

PMA

On 7/22/07, asubedi <asubedi@gmail.com> wrote:
This is probably a case where you should look at the input parameters
chkprim and brvlatt.



--
Pierre-Matthieu Anglade



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