source: ThirdParty/mpqc_open/src/bin/mpqc/validate@ 860145

Action_Thermostats Add_AtomRandomPerturbation Add_RotateAroundBondAction Add_SelectAtomByNameAction Adding_Graph_to_ChangeBondActions Adding_MD_integration_tests Adding_StructOpt_integration_tests Automaking_mpqc_open AutomationFragmentation_failures Candidate_v1.6.0 Candidate_v1.6.1 ChangeBugEmailaddress ChangingTestPorts ChemicalSpaceEvaluator Combining_Subpackages Debian_Package_split Debian_package_split_molecuildergui_only Disabling_MemDebug Docu_Python_wait EmpiricalPotential_contain_HomologyGraph_documentation Enable_parallel_make_install Enhance_userguide Enhanced_StructuralOptimization Enhanced_StructuralOptimization_continued Example_ManyWaysToTranslateAtom Exclude_Hydrogens_annealWithBondGraph FitPartialCharges_GlobalError Fix_ChronosMutex Fix_StatusMsg Fix_StepWorldTime_single_argument Fix_Verbose_Codepatterns ForceAnnealing_goodresults ForceAnnealing_oldresults ForceAnnealing_tocheck ForceAnnealing_with_BondGraph ForceAnnealing_with_BondGraph_continued ForceAnnealing_with_BondGraph_continued_betteresults ForceAnnealing_with_BondGraph_contraction-expansion GeometryObjects Gui_displays_atomic_force_velocity IndependentFragmentGrids_IntegrationTest JobMarket_RobustOnKillsSegFaults JobMarket_StableWorkerPool JobMarket_unresolvable_hostname_fix ODR_violation_mpqc_open PartialCharges_OrthogonalSummation PythonUI_with_named_parameters QtGui_reactivate_TimeChanged_changes Recreated_GuiChecks RotateToPrincipalAxisSystem_UndoRedo StoppableMakroAction Subpackage_levmar Subpackage_mpqc_open Subpackage_vmg ThirdParty_MPQC_rebuilt_buildsystem TremoloParser_IncreasedPrecision TremoloParser_MultipleTimesteps Ubuntu_1604_changes stable
Name Size Rev Age Author Last Change
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ckpt a844d8   55 years (none)
input a844d8   55 years (none)
mbpt a844d8   55 years (none)
methods a844d8   55 years (none)
ref a844d8   55 years (none)
basis1.qci 1.6 KB a844d8   55 years (none)
basis2.qci 2.0 KB a844d8   55 years (none)
ccacints.qci 313 bytes a844d8   55 years (none)
ccaintv3.qci 320 bytes a844d8   55 years (none)
checkccaout.pl 5.5 KB a844d8   55 years (none)
checkout.pl 14.7 KB a844d8   55 years (none)
clscf.qci 396 bytes a844d8   55 years (none)
dft.qci 3.4 KB a844d8   55 years (none)
h2o.qci 258 bytes a844d8   55 years (none)
h2ofrq.qci 257 bytes a844d8   55 years (none)
h2omp2.qci 271 bytes a844d8   55 years (none)
hsosscf.qci 608 bytes a844d8   55 years (none)
makeccain.pl.in 1.0 KB a844d8   55 years (none)
Makefile 26.8 KB a844d8   55 years (none)
makein.pl 15.5 KB a844d8   55 years (none)
mp2r12.qci 318 bytes a844d8   55 years (none)
opt.qci 882 bytes a844d8   55 years (none)
optts.qci 1.1 KB a844d8   55 years (none)
orthog.qci 535 bytes a844d8   55 years (none)
symm1.qci 1.1 KB a844d8   55 years (none)
symm2.qci 661 bytes a844d8   55 years (none)
symm3.qci 7.0 KB a844d8   55 years (none)
uscf.qci 619 bytes a844d8   55 years (none)
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