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exercises:2016_ethz_mmm:bs

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exercises:2016_ethz_mmm:bs [2016/05/27 14:18] dpasseroneexercises:2016_ethz_mmm:bs [2016/05/27 14:36] dpasserone
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 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.save. The scf-mol.save is required for the 'bands' calculation
-   $ cp -rf mol.save/ scf.save/+   $ cp -rf mol.save/ scf-mol.save/
  
 **Non-Self-Consistent Field (NSCF) calculation:** **Non-Self-Consistent Field (NSCF) calculation:**
exercises/2016_ethz_mmm/bs.txt · Last modified: 2020/08/21 10:15 by 127.0.0.1