source: ThirdParty/mpqc_open/src/lib/chemistry/qc/scf/tmplinst.cc@ 482400e

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_vmg ThirdParty_MPQC_rebuilt_buildsystem TremoloParser_IncreasedPrecision TremoloParser_MultipleTimesteps Ubuntu_1604_changes stable
Last change on this file since 482400e was 860145, checked in by Frederik Heber <heber@…>, 8 years ago

Merge commit '0b990dfaa8c6007a996d030163a25f7f5fc8a7e7' as 'ThirdParty/mpqc_open'
  • Property mode set to 100644
File size: 2.3 KB
Line 
1
2#ifdef HAVE_CONFIG_H
3#include <scconfig.h>
4#endif
5
6#ifdef EXPLICIT_TEMPLATE_INSTANTIATION
7
8#include <util/misc/formio.h>
9#include <chemistry/qc/basis/basis.h>
10#include <chemistry/qc/basis/petite.h>
11#include <chemistry/qc/scf/lgbuild.h>
12#include <chemistry/qc/scf/ltbgrad.h>
13
14#include <chemistry/qc/scf/clhftmpl.h>
15#include <chemistry/qc/scf/hsoshftmpl.h>
16#include <chemistry/qc/scf/osshftmpl.h>
17#include <chemistry/qc/scf/tchftmpl.h>
18#include <chemistry/qc/scf/uhftmpl.h>
19
20using namespace sc;
21
22template class GBuild<LocalCLHFContribution>;
23template class GBuild<LocalCLHFEnergyContribution>;
24
25template class LocalGBuild<LocalCLHFContribution>;
26template class LocalGBuild<LocalCLHFEnergyContribution>;
27
28template class TBGrad<LocalCLHFGradContribution>;
29template class LocalTBGrad<LocalCLHFGradContribution>;
30
31///////////////////////////////////////////////////////////////////////////
32
33template class GBuild<LocalHSOSContribution>;
34template class GBuild<LocalHSOSEnergyContribution>;
35template class LocalGBuild<LocalHSOSContribution>;
36template class LocalGBuild<LocalHSOSEnergyContribution>;
37
38template class TBGrad<LocalHSOSGradContribution>;
39template class LocalTBGrad<LocalHSOSGradContribution>;
40
41///////////////////////////////////////////////////////////////////////////
42
43template class GBuild<LocalOSSContribution>;
44template class GBuild<LocalOSSEnergyContribution>;
45template class LocalGBuild<LocalOSSContribution>;
46template class LocalGBuild<LocalOSSEnergyContribution>;
47
48template class TBGrad<LocalOSSGradContribution>;
49template class LocalTBGrad<LocalOSSGradContribution>;
50
51///////////////////////////////////////////////////////////////////////////
52
53template class GBuild<LocalTCContribution>;
54template class GBuild<LocalTCEnergyContribution>;
55template class LocalGBuild<LocalTCContribution>;
56template class LocalGBuild<LocalTCEnergyContribution>;
57
58template class TBGrad<LocalTCGradContribution>;
59template class LocalTBGrad<LocalTCGradContribution>;
60
61///////////////////////////////////////////////////////////////////////////
62
63template class GBuild<LocalUHFContribution>;
64template class GBuild<LocalUHFEnergyContribution>;
65template class LocalGBuild<LocalUHFContribution>;
66template class LocalGBuild<LocalUHFEnergyContribution>;
67
68template class TBGrad<LocalUHFGradContribution>;
69template class LocalTBGrad<LocalUHFGradContribution>;
70
71#endif
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