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Re: [abinit-forum] How can I use the previous result to restart the abinit when a power failure happened?
Chronological Thread
- From: Xavier Gonze <gonze@pcpm.ucl.ac.be>
- To: forum@abinit.org
- Subject: Re: [abinit-forum] How can I use the previous result to restart the abinit when a power failure happened?
- Date: Sun, 18 Feb 2007 23:43:27 +0100
On 18 Feb 2007, at 09:47, Hongyi Zhao wrote:
Hi all,
When a power failure happened, how can I use the previous result
to restart the abinit, so that it can be resume form the break ponit?
Dear Hongyi Zhao,
In case the purpose of your job was not to modify the atomic positions,
but to do the determination of density/electronic structure
for fixed atomic positions, you should be able to restart
by reading the last wavefunction file _WFK that was generated by ABINIT
(unless you set the input variable prtwf to 0).
In case your atomic positions / cell size were changed, you should also
copy by hand the latest ones to your input file, and also read the latest
_WFK file that was produced by ABINIT.
Good luck,
Xavier
- How can I use the previous result to restart the abinit when a power failure happened?, Hongyi Zhao, 02/18/2007
- Re: [abinit-forum] How can I use the previous result to restart the abinit when a power failure happened?, Ary Junior, 02/18/2007
- Re: [abinit-forum] How can I use the previous result to restart the abinit when a power failure happened?, Anglade Pierre-Matthieu, 02/18/2007
- Re: [abinit-forum] How can I use the previous result to restart the abinit when a power failure happened?, Xavier Gonze, 02/18/2007
- Re: [abinit-forum] How can I use the previous result to restart the abinit when a power failure happened?, Ary Junior, 02/18/2007
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