[TCOD] Tcod Digest, Vol 7, Issue 3

[Daniel Chateigner]

Yes OQMD looks interesting, and should absolutely be linked in TCOD for 
the benefit of both

daniel

Le 09/08/2014 14:00, tcod-request at lists.crystallography.net a écrit :
> Send Tcod mailing list submissions to
> 	tcod at lists.crystallography.net
>
> To subscribe or unsubscribe via the World Wide Web, visit
> 	http://lists.crystallography.net/cgi-bin/mailman/listinfo/tcod
> or, via email, send a message with subject or body 'help' to
> 	tcod-request at lists.crystallography.net
>
> You can reach the person managing the list at
> 	tcod-owner at lists.crystallography.net
>
> When replying, please edit your Subject line so it is more specific
> than "Re: Contents of Tcod digest..."
>
>
> Today's Topics:
>
>     1. The OQMD (Saulius Gra?ulis)
>
>
> ----------------------------------------------------------------------
>
> Message: 1
> Date: Sat, 09 Aug 2014 07:30:47 -0400
> From: Saulius Gra?ulis <grazulis at ibt.lt>
> To: tcod at lists.crystallography.net
> Subject: [TCOD] The OQMD
> Message-ID: <53E60667.7040301 at ibt.lt>
> Content-Type: text/plain; charset=utf-8; format=flowed
>
> Hi, folks,
>
> a day ago I have listened to the talk about the OQMD database:
>
> http://oqmd.org/
>
> Well, actually, Stefaan mentioned it in his excellent review e-mail
> (2013-09-06 12:02) on this list, but that time there was apparently no
> public access to the DB. Now there is :).
>
> The DB is very mature and is completely open -- so good to look at and
> tp collaborate with. I got in touch with Chris Wolverton, and we will
> discuss over the e-mail how to get the TCOD and OQMD cooperating nicely
> (unfortunately, Chris had to leave the conference early, so we could not
> speak in person).
>
> The TCOD's role in this situation could be to present computations in a
> standardized, CIF format from various groups. In this sense TCOD could
> be a useful complement for the computation-first databases, and would
> provide means to search and analyze computation results made by various
> groups and researchers (which is the primary TCOD intent). In any case,
> the OCMD data should be represented and referenced to in TCOD as well,
> what do you think?
>
> Have a look, and stay tuned -- and your thoughts are welcome.
>
> Regards,
> Saulius
>

-- 

----------------------------------------------------------------------
Daniel Chateigner
Professeur, Université de Caen Basse-Normandie
http://www.ecole.ensicaen.fr/~chateign/danielc/
----------------------------------------------------------------------
Editor: "Combined Analysis", Wiley-ISTE: http://eu.wiley.com/WileyCDA/WileyTitle/productCd-1848211988.html
Workshops on Combined Analysis: http://www.ecole.ensicaen.fr/~chateign/formation/
Advisory Board: Zeitschrift für Kristallographie
----------------------------------------------------------------------
Address:
CRISMAT-ENSICAEN and IUT-Caen,
Université de Caen Basse-Normandie, campus 2
6, Bd. M. Juin 14050 Caen, France
tel: 33 (0)2 31 45 26 11
fax: 33 (0)2 31 95 16 00
daniel.chateigner at ensicaen.fr
----------------------------------------------------------------------
Open Databases:
Full-Profile Search-Match: http://cod.iutcaen.unicaen.fr/
Material Properties Open Database (MPOD): http://www.materialproperties.org/
Crystallography Open Database     (COD): http://sdpd.univ-lemans.fr/cod/
                   Theoretical     (TCOD): http://sdpd.univ-lemans.fr/cod/tcod/
                   Predicted       (PCOD): http://sdpd.univ-lemans.fr/cod/pcod/
----------------------------------------------------------------------