[Pw_forum] nearest neighbor test

Giuseppe Mattioli giuseppe.mattioli at ism.cnr.it
Fri Mar 6 11:24:26 CET 2015


Dear Mulwa Winfred
This has nothing to do with installing or running the code. You should not expect substantial help on research topics from this mailing list...
You should rather search the literature.
HTH
Giuseppe

On Friday, March 06, 2015 08:49:57 AM Winfred Mulwa wrote:
> Dear all,
> I am doing a 5% doping of TiO2 with Cr in a 72 atom cell.
> please some body to explain to me how i can contact the
> nearest neighbor test in order to get the best substitution site
> please.
> Regards
> Mulwa Winfred.
> D Phil Student, Computational Material Science Group,
> University of the Free State - QwaQwa,
> South Africa.

********************************************************
- Article premier - Les hommes naissent et demeurent
libres et ègaux en droits. Les distinctions sociales
ne peuvent être fondèes que sur l'utilitè commune
- Article 2 - Le but de toute association politique
est la conservation des droits naturels et 
imprescriptibles de l'homme. Ces droits sont la libertè,
la propriètè, la sùretè et la rèsistance à l'oppression.
********************************************************

   Giuseppe Mattioli                            
   CNR - ISTITUTO DI STRUTTURA DELLA MATERIA   
   v. Salaria Km 29,300 - C.P. 10                
   I 00015 - Monterotondo Stazione (RM)          
   Tel + 39 06 90672836 - Fax +39 06 90672316    
   E-mail: <giuseppe.mattioli at ism.cnr.it>
   http://www.ism.cnr.it/english/staff/mattiolig
   ResearcherID: F-6308-2012




More information about the users mailing list