exercises:2016_ethz_mmm:bs
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| Both sides previous revisionPrevious revisionNext revision | Previous revisionLast revisionBoth sides next revision | ||
| exercises:2016_ethz_mmm:bs [2016/05/27 14:18] – dpasserone | exercises:2016_ethz_mmm:bs [2016/05/27 14:36] – dpasserone | ||
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| Line 42: | Line 42: | ||
| $ grep “Fermi energy” | $ grep “Fermi energy” | ||
| - | 6. Copy the mol.save directory to scf.save. The scf-mol.save is required for the ' | + | 6. Copy the mol.save directory to scf-mol.save. The scf-mol.save is required for the ' |
| - | $ 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