Mickaël Véril ab67b8b224 Update outpus		2020-11-18 10:01:08 +01:00
..
pyrimidine.fc.out	update output and new calculation pyridine and pyrimidine	2020-11-08 12:08:44 +01:00
pyrimidine.fci.out	update output and new calculation pyridine and pyrimidine	2020-11-08 12:08:44 +01:00
pyrimidine.natorb.out	update output and new calculation pyridine and pyrimidine	2020-11-08 12:08:44 +01:00
pyrimidine.nofci.out	Update outpus	2020-11-18 10:01:08 +01:00
pyrimidine.scf.out	update output and new calculation pyridine and pyrimidine	2020-11-08 12:08:44 +01:00
pyrimidine.xyz	Add pyridine and pyrimidine	2020-11-03 16:59:57 +01:00
run_fci.sh	Add pyridine and pyrimidine	2020-11-03 16:59:57 +01:00
slurm-490240.out	Update outpus	2020-11-18 10:01:08 +01:00