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berquist committed Oct 17, 2024
1 parent 6465a94 commit 5a87c9d
Showing 1 changed file with 4 additions and 4 deletions.
8 changes: 4 additions & 4 deletions regressionfiles.yaml
Original file line number Diff line number Diff line change
Expand Up @@ -509,17 +509,17 @@ regressions:
- loc_entry: Gaussian/Gaussian09/water_gaussian.inp.log
- loc_entry: Gaussian/Gaussian16/Benzene_anion.log
- loc_entry: Gaussian/Gaussian16/C01_CC.log
- loc_entry: Gaussian/Gaussian16/co_pbe1pbe_631ppGss.log
- loc_entry: Gaussian/Gaussian16/Ethane.mp5.log
- loc_entry: Gaussian/Gaussian16/H3_natcharge.log
- loc_entry: Gaussian/Gaussian16/Pyridine_opt-eomccsd.log
- loc_entry: Gaussian/Gaussian16/co_pbe1pbe_631ppGss.log
- loc_entry: Gaussian/Gaussian16/issue1153.log
- loc_entry: Gaussian/Gaussian16/issue851.log
- loc_entry: Gaussian/Gaussian16/issue962.log
- loc_entry: Gaussian/Gaussian16/mp2_avdz_freq_tight.log
- loc_entry: Gaussian/Gaussian16/naturalspinorbitals_parsing.log
- loc_entry: Gaussian/Gaussian16/output.txt.issue754.log
- loc_entry: Gaussian/Gaussian16/water.log
- loc_entry: Gaussian/Gaussian16/Pyridine_opt-eomccsd.log
- loc_entry: Gaussian/Gaussian98/C_bigmult.log
- loc_entry: Gaussian/Gaussian98/NIST_CCCBDB_1himidaz_m21b0.out
- loc_entry: Gaussian/Gaussian98/NIST_CCCBDB_1himidaz_m23b6.out
Expand Down Expand Up @@ -750,17 +750,17 @@ regressions:
- loc_entry: ORCA/ORCA4.1/single_atom_freq.out
- loc_entry: ORCA/ORCA4.2/947.out
- loc_entry: ORCA/ORCA4.2/MP2-gradient.out
- loc_entry: ORCA/ORCA4.2/a_DLPNO.txt
- loc_entry: ORCA/ORCA4.2/casscf.out
- loc_entry: ORCA/ORCA4.2/cope.out
- loc_entry: ORCA/ORCA4.2/ligando-30-SRM1-S_ZINDO.out
- loc_entry: ORCA/ORCA4.2/long-input.out
- loc_entry: ORCA/ORCA4.2/longer-input.out
- loc_entry: ORCA/ORCA4.2/water_dlpno_ccsd.out
- loc_entry: ORCA/ORCA4.2/a_DLPNO.txt
- loc_entry: ORCA/ORCA5.0/ADBNA_Me_Mes_MesCz.log
- loc_entry: ORCA/ORCA5.0/Benzene_opt_etsyms.log
- loc_entry: ORCA/ORCA5.0/dvb_soc.log
- loc_entry: ORCA/ORCA5.0/steom_orbs.log
- loc_entry: ORCA/ORCA5.0/Benzene_opt_etsyms.log
- loc_entry: Psi3/Psi3.4/dvb_sp_hf.out
tests:
- Psi3SPTest
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