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exercises:2016_ethz_mmm:bs

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exercises:2016_ethz_mmm:bs [2016/05/27 14:36]
dpasserone
exercises:2016_ethz_mmm:bs [2016/05/27 14:36] (current)
dpasserone
Line 42: Line 42:
    $ grep “Fermi energy” ​ SCF.out | tail -1    $ grep “Fermi energy” ​ SCF.out | tail -1
  
-6. Copy the mol.save directory to scf.save. The scf-mol.save is required for the '​bands'​ calculation+6. Copy the mol.save directory to scf-mol.save. The scf-mol.save is required for the '​bands'​ calculation
    $ cp -rf mol.save/ scf-mol.save/​    $ cp -rf mol.save/ scf-mol.save/​
  
exercises/2016_ethz_mmm/bs.txt · Last modified: 2016/05/27 14:36 by dpasserone