[ase-users] How to set zero energy at Initial configuration

[Abid Channa]

Hi ASE users,
I am working on NEB calculations, for that usually we set two configurations initial and final, before starting NEB calculations, "how to set zero energy at initial position or in other words "How to set energy of system (at initial configuration) equal to the binding energy of an adatom".
Best, 
_________________________________
                    ABID ALI                    
 
University of Iceland.


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