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exercises:2016_ethz_mmm:surface_au

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 exercises:2016_ethz_mmm:surface_au [2016/03/11 10:58]yakutovich exercises:2016_ethz_mmm:surface_au [2016/03/11 11:02] (current)yakutovich Both sides previous revision Previous revision 2016/03/11 11:02 yakutovich 2016/03/11 10:58 yakutovich 2016/03/11 10:28 yakutovich 2016/03/10 09:52 yakutovich 2016/03/09 22:55 yakutovich 2016/02/03 09:54 external edit 2016/03/11 11:02 yakutovich 2016/03/11 10:58 yakutovich 2016/03/11 10:28 yakutovich 2016/03/10 09:52 yakutovich 2016/03/09 22:55 yakutovich 2016/02/03 09:54 external edit Line 67: Line 67: The compute_surf* scripts give an idea how to compute the surface energies. The compute_surf* scripts give an idea how to compute the surface energies. - In the next step, we work with 2 reconstructed surfaces: the 110_rec.xyz and the 100_rec.xyz. For this calculations you will need to use the same unit cell parameters as for the corresponding unreconstracted surface structures that you have built previously. ​ + In the next step, we work with 2 reconstructed surfaces ​given in the 100_rec.xyz and 110_rec.xyz files. For this calculations you will need to use the same unit cell parameters as for the corresponding unreconstracted surface structures that you have built previously. ​