Ec/benzene/cc-pvdz
2020-11-26 20:40:53 +01:00
..
benzene.ang update benzene loc 2020-11-14 10:54:19 +01:00
benzene.fc.out benzene and furan 2020-10-26 21:58:41 +01:00
benzene.fci.out localization scripts 2020-11-04 16:04:33 +01:00
benzene.localized.nofci.out update 2020-11-26 20:15:38 +01:00
benzene.mo update benzene loc 2020-11-14 10:54:19 +01:00
benzene.natorb.out update T2 2020-11-10 20:33:15 +01:00
benzene.nofci.out update benzene loc 2020-11-14 10:51:02 +01:00
benzene.restart.nofci.out restart benzene 2020-11-26 20:40:53 +01:00
benzene.scf.out benzene 2020-11-03 22:26:03 +01:00
benzene.xyz benzene 2020-11-03 22:26:03 +01:00
localize.sh update benzene loc 2020-11-14 10:54:19 +01:00
run_fci.sh benzene and furan 2020-10-26 21:58:41 +01:00
run_loc.sh update benzene loc 2020-11-14 10:54:19 +01:00
run_restart.sh restart benzene 2020-11-26 20:40:53 +01:00
slurm-490111.out update benzene loc 2020-11-14 10:51:02 +01:00