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- From: Xavier Gonze <gonze@pcpm.ucl.ac.be>
- To: forum@abinit.org
- Subject: Re: [abinit-forum] {SPAM?} Problem when calculating on LiNiO2
- Date: Thu, 29 Dec 2005 14:27:58 +0100
Dear Hongbin Zhang,
Please, could you send your full input file, and the error message from the output file ?
Xavier
On 25 Dec 2005, at 10:58, 张 洪彬 wrote:
Dear all:
May you have a merry Christmas first.
Now I am doing some calculation on LiNiO2, but there are some problems with my input file:
ntypat 3
znucl 3 8 28
natom 12
typat 1 3 2 2 1 3 2 2 1 3 2 2
xred
< I give 12 reduced coordinates of atoms here>
However, the abinis stoped and said that there should be 36 arrays provided. Please help me.
Best regards.
Hongbin Zhang
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- {SPAM?} Problem when calculating on LiNiO2, 张 洪彬, 12/25/2005
- Re: [abinit-forum] {SPAM?} Problem when calculating on LiNiO2, Xavier Gonze, 12/29/2005
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