"make install" doesn't install atompaw

option, parallelism,...

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jzwanzig
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Joined: Mon Aug 17, 2009 9:25 am

"make install" doesn't install atompaw

Post by jzwanzig » Wed Mar 19, 2014 1:30 pm

Hi,

I find at least with 7.6.2 that, using atompaw as a fallback, it gets compiled by make but then "make install" doesn't install it to the /opt/abinit... prefix I had set. Is there a different make target I should be using or is this an overlooked issue?

thanks,
Joe
Josef W. Zwanziger
Professor, Department of Chemistry
Canada Research Chair in NMR Studies of Materials
Dalhousie University
Halifax, NS B3H 4J3 Canada
jzwanzig@gmail.com

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pouillon
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Location: Spain
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Re: "make install" doesn't install atompaw

Post by pouillon » Thu Mar 20, 2014 7:32 pm

AtomPAW in Abinit is only used for some tests when a new version of AtomPAW is released. If you intend to use it for production, the best is to build it separately.

I'll look at the issue when I have some time, but it is possible that it has already been fixed in 7.7.
Yann Pouillon
Simune Atomistics
Donostia-San Sebastián, Spain

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jzwanzig
Posts: 504
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Re: "make install" doesn't install atompaw

Post by jzwanzig » Thu Mar 20, 2014 7:36 pm

Thanks, I had come to that conclusion, I think the documentation on the PAW generation page needs to be updated. I'll try to do that when I check some of the other tutorial pages for the upcoming Lyon school.

Joe
Josef W. Zwanziger
Professor, Department of Chemistry
Canada Research Chair in NMR Studies of Materials
Dalhousie University
Halifax, NS B3H 4J3 Canada
jzwanzig@gmail.com

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torrent
Posts: 127
Joined: Fri Aug 14, 2009 7:40 pm

Re: "make install" doesn't install atompaw

Post by torrent » Mon Mar 31, 2014 6:26 pm

Joe,

I don't think the tutorial PAW2 has to be changed; the atompaw executable is clearly located (I was aware of this make install issue).

First, just try to type: atompaw
if "atompaw vx.y.z" message appears, everything is fine.
Otherwise, you can try "~abinit_compilation_directory/fallbacks/exports/bin/atompaw-abinit"


Marc
Marc Torrent
CEA - Bruyères-le-Chatel
France

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