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- From: Xavier Gonze <xavier.gonze@uclouvain.be>
- To: forum@abinit.org
- Subject: Re: [abinit-forum] asking for a pseudopotential about fe
- Date: Wed, 26 Dec 2007 17:29:44 +0100
Dear Lihong Ni,
If you are simply interested in total energy, forces, stresses, for geometry optimization or molecular
dynamics, you can use the PAW one in http://www.abinit.org/PAW/MAIN/ PAWTable.html .
X.
On 13 Dec 2007, at 14:55, asila wrote:
dear abinit users,
I will be grateful to anyone who can share with a pseudopotential about fe, better with semicore correction.
Thank you very much!
yours, Lihong Ni
- asking for a pseudopotential about fe, asila, 12/13/2007
- Re: [abinit-forum] asking for a pseudopotential about fe, Xavier Gonze, 12/26/2007
- about wavelets, Durgun Engin, 12/28/2007
- Re: [abinit-forum] about wavelets, Anglade Pierre-Matthieu, 12/29/2007
- Re: [abinit-forum] about wavelets, Durgun Engin, 12/30/2007
- Re: [abinit-forum] about wavelets, Anglade Pierre-Matthieu, 12/29/2007
- about wavelets, Durgun Engin, 12/28/2007
- Re: [abinit-forum] asking for a pseudopotential about fe, Xavier Gonze, 12/26/2007
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