[Pw_forum] graphen with adatoms input

yelena yelena at ipb.ac.rs
Fri May 31 00:26:13 CEST 2013


Yes, monolayer graphene with adatoms in center of lattice. like this: 
http://www.nature.com/nphys/journal/v8/n2/images/nphys2181-f1.jpg

On 30 May 2013 20:08, Paolo Giannozzi wrote:
> On Thu, 2013-05-30 at 16:39 +0200, yelena wrote:
>
>> ATOMIC_POSITIONS crystal
>>   C 0.000000  0.000000 0.000000
>>   C 0.333333  -0.33333 0.000000
>> Li 0.666666  0.333333 0.000000
>
> all these atoms are in the same plane (xy). Is this what you want?
>
> P.




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