Ec/cyclopentadiene/cc-pvdz
2020-10-27 11:04:04 +01:00
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cyclopentadiene.fc.out Add firsts output of cyclopentadiene cc-pvdz 2020-10-27 11:04:04 +01:00
cyclopentadiene.scf.out Add firsts output of cyclopentadiene cc-pvdz 2020-10-27 11:04:04 +01:00
cyclopentadiene.xyz Add cyclopentadiene.xyz 2020-10-27 10:21:05 +01:00
run_fci.sh cyclopentadiene 2020-10-27 09:42:09 +01:00