source: ThirdParty/mpqc_open/src/bin/mpqc/validate/methods@ 7516f6

Action_Thermostats Adding_MD_integration_tests Adding_StructOpt_integration_tests AutomationFragmentation_failures Candidate_v1.6.1 Candidate_v1.7.0 Candidate_v1.7.1 ChemicalSpaceEvaluator Enhanced_StructuralOptimization Enhanced_StructuralOptimization_continued Exclude_Hydrogens_annealWithBondGraph Fix_Verbose_Codepatterns ForceAnnealing_with_BondGraph ForceAnnealing_with_BondGraph_continued ForceAnnealing_with_BondGraph_continued_betteresults ForceAnnealing_with_BondGraph_contraction-expansion Gui_displays_atomic_force_velocity JobMarket_RobustOnKillsSegFaults JobMarket_StableWorkerPool PythonUI_with_named_parameters Recreated_GuiChecks StoppableMakroAction TremoloParser_IncreasedPrecision stable
Name Size Rev Age Author Last Change
../
uks_xa.qci 30 bytes ​ 5169d1b   57 years (none)
uks_xa.in 736 bytes ​ 5169d1b   57 years (none)
uks_lsdax.qci 30 bytes ​ 5169d1b   57 years (none)
uks_lsdax.in 737 bytes ​ 5169d1b   57 years (none)
uks_kmlyp.qci 30 bytes ​ 5169d1b   57 years (none)
uks_kmlyp.in 748 bytes ​ 5169d1b   57 years (none)
uks_blyp.qci 30 bytes ​ 5169d1b   57 years (none)
uks_blyp.in 888 bytes ​ 5169d1b   57 years (none)
uks_b88.qci 30 bytes ​ 5169d1b   57 years (none)
uks_b88.in 855 bytes ​ 5169d1b   57 years (none)
uks_b3lyp.qci 30 bytes ​ 5169d1b   57 years (none)
uks_b3lyp.in 939 bytes ​ 5169d1b   57 years (none)
uhf.qci 30 bytes ​ 5169d1b   57 years (none)
uhf.in 699 bytes ​ 5169d1b   57 years (none)
tchf.qci 30 bytes ​ 5169d1b   57 years (none)
tchf.in 658 bytes ​ 5169d1b   57 years (none)
qmmm2.qci 30 bytes ​ 5169d1b   57 years (none)
qmmm2.in 1017 bytes ​ 5169d1b   57 years (none)
qmmm1.qci 30 bytes ​ 5169d1b   57 years (none)
qmmm1.in 1017 bytes ​ 5169d1b   57 years (none)
osshf.qci 30 bytes ​ 5169d1b   57 years (none)
osshf.in 659 bytes ​ 5169d1b   57 years (none)
mp2r12ap_nogebc.qci 29 bytes ​ 5169d1b   57 years (none)
mp2r12ap_nogebc.in 6.6 KB ​ 5169d1b   57 years (none)
mp2r12ap_cabs.qci 29 bytes ​ 5169d1b   57 years (none)
mp2r12ap_cabs.in 6.6 KB ​ 5169d1b   57 years (none)
mp2r12ap_cabs+.qci 29 bytes ​ 5169d1b   57 years (none)
mp2r12ap_cabs+.in 6.6 KB ​ 5169d1b   57 years (none)
mp2r12ap_abs.qci 29 bytes ​ 5169d1b   57 years (none)
mp2r12ap_abs.in 6.6 KB ​ 5169d1b   57 years (none)
mp2r12ap_abs+.qci 29 bytes ​ 5169d1b   57 years (none)
mp2r12ap_abs+.in 6.6 KB ​ 5169d1b   57 years (none)
mp2r12ap_+gbc.qci 29 bytes ​ 5169d1b   57 years (none)
mp2r12ap_+gbc.in 6.6 KB ​ 5169d1b   57 years (none)
mp2r12ap_+gbc+ebc.qci 29 bytes ​ 5169d1b   57 years (none)
mp2r12ap_+gbc+ebc.in 6.6 KB ​ 5169d1b   57 years (none)
mp2r12ap_+ebc.qci 29 bytes ​ 5169d1b   57 years (none)
mp2r12ap_+ebc.in 6.6 KB ​ 5169d1b   57 years (none)
hsosks_xa.qci 30 bytes ​ 5169d1b   57 years (none)
hsosks_xa.in 742 bytes ​ 5169d1b   57 years (none)
hsosks_lsdax.qci 30 bytes ​ 5169d1b   57 years (none)
hsosks_lsdax.in 743 bytes ​ 5169d1b   57 years (none)
hsosks_kmlyp.qci 30 bytes ​ 5169d1b   57 years (none)
hsosks_kmlyp.in 754 bytes ​ 5169d1b   57 years (none)
hsosks_blyp.qci 30 bytes ​ 5169d1b   57 years (none)
hsosks_blyp.in 894 bytes ​ 5169d1b   57 years (none)
hsosks_b88.qci 30 bytes ​ 5169d1b   57 years (none)
hsosks_b88.in 861 bytes ​ 5169d1b   57 years (none)
hsosks_b3lyp.qci 30 bytes ​ 5169d1b   57 years (none)
hsosks_b3lyp.in 945 bytes ​ 5169d1b   57 years (none)
hsoshf.qci 30 bytes ​ 5169d1b   57 years (none)
hsoshf.in 705 bytes ​ 5169d1b   57 years (none)
clks_xa.qci 30 bytes ​ 5169d1b   57 years (none)
clks_xa.in 772 bytes ​ 5169d1b   57 years (none)
clks_lsdax.qci 30 bytes ​ 5169d1b   57 years (none)
clks_lsdax.in 773 bytes ​ 5169d1b   57 years (none)
clks_kmlyp.qci 30 bytes ​ 5169d1b   57 years (none)
clks_kmlyp.in 784 bytes ​ 5169d1b   57 years (none)
clks_blyp.qci 30 bytes ​ 5169d1b   57 years (none)
clks_blyp.in 924 bytes ​ 5169d1b   57 years (none)
clks_b88.qci 30 bytes ​ 5169d1b   57 years (none)
clks_b88.in 891 bytes ​ 5169d1b   57 years (none)
clks_b3lyp.qci 30 bytes ​ 5169d1b   57 years (none)
clks_b3lyp.in 975 bytes ​ 5169d1b   57 years (none)
clhf.qci 30 bytes ​ 5169d1b   57 years (none)
clhf.in 735 bytes ​ 5169d1b   57 years (none)
  • Property mode set to 040000
Note: See TracBrowser for help on using the repository browser.