[ase-users] Potential energy surface from ase-siesta NEB calculations

Boubacar Traore traorehade at yahoo.fr
Mon Nov 10 21:33:41 CET 2014


Dear all,


I would like to know if it is possible to draw the potential energy surface (PES) from ASE neb calculations. I did my calculations with ASE siesta. If yes, could you please tell me how (for exemple in contour map or 3d representation)?
Best regards,
Boubacar 

   
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