position of doped atoms ,mixalch

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cengiz
Posts: 22
Joined: Tue Sep 25, 2012 3:36 pm

position of doped atoms ,mixalch

Post by cengiz » Sun Jul 28, 2013 1:00 am

hi all

i try to dope ZnO with Mn and use mixalch input variables .
i interest position of doped atom ,

for example
i doped ZnO with Mn % 5 , abinit how to creat crysytal structure and what is position of doped atom .
if i used supercell , i know position of doped atoms

thank for help
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