source: ThirdParty/mpqc_open/src/bin/mpqc/validate/input@ 15d21e

Action_Thermostats Add_AtomRandomPerturbation Add_SelectAtomByNameAction Adding_Graph_to_ChangeBondActions Adding_MD_integration_tests Adding_StructOpt_integration_tests AutomationFragmentation_failures Candidate_v1.6.1 Candidate_v1.7.0 Candidate_v1.7.1 ChangeBugEmailaddress ChemicalSpaceEvaluator Docu_Python_wait EmpiricalPotential_contain_HomologyGraph_documentation Enhance_userguide Enhanced_StructuralOptimization Enhanced_StructuralOptimization_continued Example_ManyWaysToTranslateAtom Exclude_Hydrogens_annealWithBondGraph Fix_StepWorldTime_single_argument Fix_Verbose_Codepatterns ForceAnnealing_oldresults ForceAnnealing_with_BondGraph ForceAnnealing_with_BondGraph_continued ForceAnnealing_with_BondGraph_continued_betteresults ForceAnnealing_with_BondGraph_contraction-expansion Gui_displays_atomic_force_velocity IndependentFragmentGrids_IntegrationTest JobMarket_RobustOnKillsSegFaults JobMarket_StableWorkerPool PythonUI_with_named_parameters QtGui_reactivate_TimeChanged_changes Recreated_GuiChecks StoppableMakroAction TremoloParser_IncreasedPrecision TremoloParser_MultipleTimesteps stable
Name Size Rev Age Author Last Change
../
zapt2ch2.in 158 bytes ​ 5169d1b   57 years (none)
uksch2.in 183 bytes ​ 5169d1b   57 years (none)
uhfch2opt.in 169 bytes ​ 5169d1b   57 years (none)
rksch2.in 183 bytes ​ 5169d1b   57 years (none)
rhfch2opt.in 169 bytes ​ 5169d1b   57 years (none)
mp2r12aph2o.in 191 bytes ​ 5169d1b   57 years (none)
mp2r12ah2o.in 190 bytes ​ 5169d1b   57 years (none)
mp2h2o.in 162 bytes ​ 5169d1b   57 years (none)
ksh2oco.in 189 bytes ​ 5169d1b   57 years (none)
ksh2o.in 175 bytes ​ 5169d1b   57 years (none)
hfh2oopt.in 161 bytes ​ 5169d1b   57 years (none)
hfh2ofreq.in 164 bytes ​ 5169d1b   57 years (none)
hfch2opt.in 168 bytes ​ 5169d1b   57 years (none)
  • Property mode set to 040000
Note: See TracBrowser for help on using the repository browser.