indium tin oxide clusters

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1

Dear LAMMPS users ,

I need to do some MD simulations on indium tin oxide clusters .
I checked so many papers and also LAMMPS mailing list but I couldn’t find any idea about that .
Do you have any experience about these kinds of simulation ?
Can I use coarse-grained method like : LAMMPS​ examples/USER/cg-cmm
Which potential you think is acceptable for that ?

Regards,
Saeed.

2

Dear LAMMPS users ,

I need to do some MD simulations on indium tin oxide clusters .
I checked so many papers and also LAMMPS mailing list but I couldn't find
any idea about that .
Do you have any experience about these kinds of simulation ?

i've only heard people discussing these kind of compounds on mailing
lists of DFT codes.

Can I use coarse-grained method like : LAMMPS examples/USER/cg-cmm

absolutely not. the SDK coarse grain model is for molecules.

axel.