[ase-users] EAM calculator

Chaudhry, Anurag anurag.chaudhry at intel.com
Wed Mar 4 02:22:37 CET 2015


Hi All,

I was trying out the EAM calculator in ASE by following the example mentioned in the documentation ..
from ase.calculators.eam import EAM

mishin = EAM(potential='Al99.eam.alloy')
mishin.plot()

I download the EAM potential from NIST potential repository but I do not get the plot as expected.  Am I missing something or is there another way to get the plot to be displayed ?

thanks,
Anurag
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