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Folder: tests
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d | rwxr-xr-x | 78 | Basis_Tests |
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d | rwxr-xr-x | 98 | casscf-fzc-sp |
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d | rwxr-xr-x | 119 | casscf-opt |
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d | rwxr-xr-x | 95 | casscf-opt-numer |
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d | rwxr-xr-x | 78 | casscf-sa-sp |
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d | rwxr-xr-x | 98 | casscf-sp |
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d | rwxr-xr-x | 98 | casscf-sp-reorder |
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d | rwxr-xr-x | 74 | cc1 |
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d | rwxr-xr-x | 57 | cc10 |
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d | rwxr-xr-x | 73 | cc11 |
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d | rwxr-xr-x | 73 | cc12 |
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d | rwxr-xr-x | 74 | cc13 |
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d | rwxr-xr-x | 74 | cc13a |
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d | rwxr-xr-x | 94 | cc14 |
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d | rwxr-xr-x | 73 | cc15 |
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d | rwxr-xr-x | 57 | cc16 |
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d | rwxr-xr-x | 57 | cc17 |
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d | rwxr-xr-x | 73 | cc18 |
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d | rwxr-xr-x | 73 | cc19 |
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d | rwxr-xr-x | 74 | cc2 |
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d | rwxr-xr-x | 74 | cc21 |
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d | rwxr-xr-x | 73 | cc22 |
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d | rwxr-xr-x | 94 | cc23 |
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d | rwxr-xr-x | 74 | cc24 |
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d | rwxr-xr-x | 74 | cc25 |
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d | rwxr-xr-x | 94 | cc26 |
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d | rwxr-xr-x | 94 | cc27 |
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d | rwxr-xr-x | 57 | cc28 |
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d | rwxr-xr-x | 57 | cc29 |
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d | rwxr-xr-x | 94 | cc3 |
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d | rwxr-xr-x | 73 | cc30 |
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d | rwxr-xr-x | 57 | cc31 |
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d | rwxr-xr-x | 57 | cc32 |
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d | rwxr-xr-x | 73 | cc33 |
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d | rwxr-xr-x | 73 | cc34 |
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d | rwxr-xr-x | 57 | cc35 |
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d | rwxr-xr-x | 57 | cc36 |
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d | rwxr-xr-x | 73 | cc37 |
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d | rwxr-xr-x | 73 | cc38 |
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d | rwxr-xr-x | 57 | cc39 |
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d | rwxr-xr-x | 57 | cc4 |
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d | rwxr-xr-x | 73 | cc40 |
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d | rwxr-xr-x | 73 | cc41 |
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d | rwxr-xr-x | 57 | cc42 |
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d | rwxr-xr-x | 57 | cc43 |
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d | rwxr-xr-x | 73 | cc44 |
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d | rwxr-xr-x | 73 | cc45 |
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d | rwxr-xr-x | 57 | cc46 |
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d | rwxr-xr-x | 57 | cc47 |
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d | rwxr-xr-x | 73 | cc48 |
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d | rwxr-xr-x | 73 | cc49 |
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d | rwxr-xr-x | 73 | cc5 |
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d | rwxr-xr-x | 57 | cc50 |
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d | rwxr-xr-x | 73 | cc6 |
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d | rwxr-xr-x | 73 | cc7 |
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d | rwxr-xr-x | 57 | cc8 |
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d | rwxr-xr-x | 57 | cc8a |
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d | rwxr-xr-x | 73 | cc9 |
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d | rwxr-xr-x | 73 | cc9a |
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d | rwxr-xr-x | 52 | ci-tdm |
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d | rwxr-xr-x | 22 | cints-d1eri |
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d | rwxr-xr-x | 73 | cis-sp |
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d | rwxr-xr-x | 73 | cisd-h2o+-0 |
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d | rwxr-xr-x | 57 | cisd-h2o+-1 |
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d | rwxr-xr-x | 57 | cisd-h2o+-2 |
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d | rwxr-xr-x | 94 | cisd-opt-numer |
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d | rwxr-xr-x | 73 | cisd-sp |
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d | rwxr-xr-x | 57 | cisd-sp-2 |
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d | rwxr-xr-x | 57 | dboc-rcisd1 |
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d | rwxr-xr-x | 73 | dboc-rhf1 |
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d | rwxr-xr-x | 73 | dboc-rocisd1 |
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d | rwxr-xr-x | 57 | dboc-rohf1 |
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d | rwxr-xr-x | 57 | dboc-uhf1 |
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d | rwxr-xr-x | 94 | extrema-deloc |
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d | rwxr-xr-x | 94 | extrema-zmat |
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d | rwxr-xr-x | 57 | fci-dipole |
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d | rwxr-xr-x | 57 | fci-h2o |
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d | rwxr-xr-x | 73 | fci-h2o-2 |
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d | rwxr-xr-x | 73 | fci-h2o-clpse |
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d | rwxr-xr-x | 57 | fci-h2o-fzcv |
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d | rwxr-xr-x | 57 | fci-trans |
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d | rwxr-xr-x | 73 | mcscf-rhf1 |
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d | rwxr-xr-x | 73 | mcscf-rohf1 |
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d | rwxr-xr-x | 57 | mcscf-twocon1 |
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d | rwxr-xr-x | 57 | mp2-direct-sp |
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d | rwxr-xr-x | 73 | mp2-oeprop |
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d | rwxr-xr-x | 94 | mp2-opt |
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d | rwxr-xr-x | 74 | mp2-opt-fragments |
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d | rwxr-xr-x | 74 | mp2-opt-numer |
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d | rwxr-xr-x | 73 | mp2-scs |
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d | rwxr-xr-x | 73 | mp2-sp |
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d | rwxr-xr-x | 57 | mp2r12-sp1 |
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d | rwxr-xr-x | 62 | psi_start |
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d | rwxr-xr-x | 73 | psimrcc-sp1 |
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d | rwxr-xr-x | 98 | rasscf-sp |
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d | rwxr-xr-x | 39 | rb-ccsd-opt-grad |
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d | rwxr-xr-x | 39 | rb-ccsd_t-sp |
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d | rwxr-xr-x | 51 | rb-fci-h2o |
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d | rwxr-xr-x | 51 | rb-scf-opt-numer |
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d | rwxr-xr-x | 57 | rhf-lindep1 |
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d | rwxr-xr-x | 75 | rhf-oeprop |
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d | rwxr-xr-x | 98 | rhf-stab |
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d | rwxr-xr-x | 73 | rohf-lindep1 |
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d | rwxr-xr-x | 79 | rohf-stab |
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d | rwxr-xr-x | 78 | scf+d-freq |
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d | rwxr-xr-x | 94 | scf+d-opt1 |
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d | rwxr-xr-x | 94 | scf-fc-numer |
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d | rwxr-xr-x | 91 | scf-freq |
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d | rwxr-xr-x | 74 | scf-freq-first-3 |
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d | rwxr-xr-x | 73 | scf-freq-first-3a |
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d | rwxr-xr-x | 94 | scf-freq-first-5 |
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d | rwxr-xr-x | 57 | scf-freq-first-5a |
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d | rwxr-xr-x | 57 | scf-freq-none-3 |
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d | rwxr-xr-x | 73 | scf-freq-none-5 |
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d | rwxr-xr-x | 94 | scf-mvd-opt |
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d | rwxr-xr-x | 74 | scf-mvd-opt-numer |
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d | rwxr-xr-x | 74 | scf-mvd-opt-numer-puream |
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d | rwxr-xr-x | 94 | scf-mvd-opt-puream |
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d | rwxr-xr-x | 94 | scf-opt |
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d | rwxr-xr-x | 74 | scf-opt-fragments |
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d | rwxr-xr-x | 74 | scf-opt-numer |
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d | rwxr-xr-x | 94 | scf-opt10 |
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d | rwxr-xr-x | 94 | scf-opt11 |
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d | rwxr-xr-x | 74 | scf-opt12 |
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d | rwxr-xr-x | 74 | scf-opt2 |
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d | rwxr-xr-x | 94 | scf-opt2-numer |
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d | rwxr-xr-x | 94 | scf-opt3 |
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d | rwxr-xr-x | 74 | scf-opt4 |
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d | rwxr-xr-x | 74 | scf-opt5 |
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d | rwxr-xr-x | 94 | scf-opt6 |
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d | rwxr-xr-x | 94 | scf-opt7 |
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d | rwxr-xr-x | 74 | scf-opt9 |
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d | rwxr-xr-x | 57 | scf-polar |
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d | rwxr-xr-x | 94 | scf-symm-fc-numer |
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d | rwxr-xr-x | 73 | uhf-lindep1 |
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d | rwxr-xr-x | 78 | uhf-stab |
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d | rwxr-xr-x | 85 | uhf-stab-follow |
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d | rwxr-xr-x | 73 | zaptn-nh2 |
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- | rw-r--r-- | 4,863 | INDEX |
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- | rw-r--r-- | 251 | MakeRules.in |
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- | rw-r--r-- | 293 | MakeVars.in |
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- | rw-r--r-- | 3,461 | Makefile.in |
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- | rw-r--r-- | 2,194 | README-NEW-TESTS |
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- | rwxr-xr-x | 9,736 | driver.test.pl |
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- | rwxr-xr-x | 62,538 | psitest.pl |
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- | rwxr-xr-x | 105 | runtest.pl.in |