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- From: Alex D <alexz2591@yahoo.com>
- To: forum@abinit.org
- Subject: Re: [abinit-forum] rprim
- Date: Sat, 10 Nov 2007 11:22:52 -0800 (PST)
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Thank you for the answer but I'm looking for the rprim of a base-centered orthorhombic system like alpha-Ga
Yours
----- Original Message ----
From: Anglade Pierre-Matthieu <anglade@gmail.com>
To: forum@abinit.org
Sent: Tuesday, November 6, 2007 9:36:26 AM
Subject: Re: [abinit-forum] rprim
Hi,
For an orthorombic system you can use either:
rprim 1 0 0 0 1 0 0 0 1
acell a b c
or
rprim 1 0 0 0 b/a 0 0 0 c/a
acell a
or any variant of the later
regards,
PMA
On 11/5/07, alexz2591@yahoo.com <alexz2591@yahoo.com> wrote:
> Dear users,
>
> I'm looking for the rprim value of an orthormobic base-centered crystal, Could you help me?
> Thank you
>
--
Pierre-Matthieu Anglade
From: Anglade Pierre-Matthieu <anglade@gmail.com>
To: forum@abinit.org
Sent: Tuesday, November 6, 2007 9:36:26 AM
Subject: Re: [abinit-forum] rprim
Hi,
For an orthorombic system you can use either:
rprim 1 0 0 0 1 0 0 0 1
acell a b c
or
rprim 1 0 0 0 b/a 0 0 0 c/a
acell a
or any variant of the later
regards,
PMA
On 11/5/07, alexz2591@yahoo.com <alexz2591@yahoo.com> wrote:
> Dear users,
>
> I'm looking for the rprim value of an orthormobic base-centered crystal, Could you help me?
> Thank you
>
--
Pierre-Matthieu Anglade
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- Re: [abinit-forum] rprim, Alex D, 11/10/2007
- Re: [abinit-forum] rprim, Xavier Gonze, 11/10/2007
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