The ABINIT Users Mailing List ( CLOSED )

[Masayoshi Mikami <mmikami@yk.rim.or.jp>]

Dear Oliver (and new subscribers),

OK. It might be a good occasion to look into 
the recently updated ABINIT site (www.abinit.org).
("Merci beaucoup" for the Web masters !)

We are now supposed to visit "About ABINIT/Contact us":
http://www.abinit.org/about/?text=contact

and read the Netiquette (PLEASE !),
http://www.abinit.org/community/?text=netiquette

Then visit the FAQ list:
http://www.abinit.org/about/?text=../Infos/FAQ
(If you are so hurry, you might want to use 
 "Search in this page" option in your Browser, 
 e.g. "Ctrl-F", and search the page with your keywords)

In your case, you will notice an FAQ here :
http://www.abinit.org/about/?text=../Infos/FAQ#crystal_data
There you might be interested in the e-mails cited as #1, #2 etc.
Then you might want to dig in the Test_* jobs (using "grep" tips:
  http://www.abinit.org/ABINIT/Infos/FAQ.html#find_doc ).
You could find some (many?) inputs useful as templates for your jobs.

Good Luck,
Masayoshi

On Tue, 23 Nov 2004 13:23:39 +0100
oliver.potzel@chemie.uni-ulm.de wrote:

> Hello
> 
> I'm interested in defining a cell only by using the spacegroup and the 
> Wyckoff positions. Did anyone ever try this?
> 
> Oli