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c5e680b63a
Ec/pyrrole/cc-pvdz
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Mickaël Véril c5e680b63a Update outputs
2020-11-19 10:52:40 +01:00
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pyrrole.fc.out Update outputs 2020-11-16 09:46:09 +01:00
pyrrole.fci.out Update outputs 2020-11-16 09:46:09 +01:00
pyrrole.natorb.out Update outputs 2020-11-16 09:46:09 +01:00
pyrrole.nofci.out Update outputs 2020-11-19 10:52:40 +01:00
pyrrole.scf.out Update outputs 2020-11-16 09:46:09 +01:00
pyrrole.xyz Add pyrrole 2020-11-12 11:07:00 +01:00
run_fci.sh Add pyrrole 2020-11-12 11:07:00 +01:00
slurm-494951.out Update outputs 2020-11-19 10:52:40 +01:00