Dear Qingying and Anatoly,
thank you very much for your quick help!
It is very much appreciated.
With kind regards
Felix
On 23/06/2017 22:57, Anatoly Frenkel wrote:
... and if the random alloy is a nanoparticle, the equations are
modified (they will be the same as in Qingying's email in
... and if the random alloy is a nanoparticle, the equations are modified
(they will be the same as in Qingying's email in the bulk alloy limit and
if the NPs are sufficiently large).
See here, Eq. (11), for more details:
Chem. Soc. Reviews *41*, 8163-8178 (2012)
Hi Felix,
Your assumptions are not correct because the model you use is not a
representative unit cluster model. Basically the following three equations
are always correct for foil:
NPt-Pt+NPt-Co=12
NCo-Co+NCo-Pt=12
NCo-Pt/NPt-Co=9
And the specific values for the coordination number can be
