Mickaël Véril db123b85ab Restart pyridine

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..

localize.sh

Localise pyridine

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pyridine.ang

Localise pyridine

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pyridine.fc.out

update output and new calculation pyridine and pyrimidine

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pyridine.fci.out

update output and new calculation pyridine and pyrimidine

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pyridine.localized.nofci.out

Update outputs

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pyridine.mo

Update files

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pyridine.natorb.out

update output and new calculation pyridine and pyrimidine

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pyridine.nofci.out

Update outpus

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pyridine.scf.out

update output and new calculation pyridine and pyrimidine

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pyridine.xyz

Add pyridine and pyrimidine

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run_fci.sh

Add pyridine and pyrimidine

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run_loc.sh

Localise pyridine

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run_restart.sh

Restart pyridine

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slurm-490268.out

Update outpus

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slurm-508621.out

Update outputs

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