The ABINIT Users Mailing List ( CLOSED )

[Xavier Gonze <gonze@pcpm.ucl.ac.be>]

Dear hua Bao,

On 13 Jul 2007, at 02:27, Hua Bao wrote:

> Dear abinit-users,
>
> Electron density of state should be able to be derived directly  
> from KS band structure. Does this function implement in abinit? How  
> to do that?
>
> BTW, if I need to calculate a special physical property, how can I  
> know whether it is implement in abinit?

The list of features of ABINIT is available on the Web :
http://www.abinit.org/Infos_v5.4/features/features.html

> How can I find related variables or packages?
Unfortunately, there is no link from the above-mentioned list to the  
input variables, or to
automatic tests with input files. Also, we should (will ?) provide  
soon, a
search engine on the ABINIT Web site.
So, at present I suggest you make a  "grep" of the best keyword that  
you can find,
in the following directories :
doc/input_variables
doc/users
and also, in order to find the automatic tests input files, in the files
tests/*/README

Good luck,
Xavier

> Thanks,
> Hua