Changeset 23612c for ThirdParty/mpqc_open
- Timestamp:
- Mar 2, 2017, 12:28:36 PM (8 years ago)
- Branches:
- Action_Thermostats, Add_AtomRandomPerturbation, Add_RotateAroundBondAction, Add_SelectAtomByNameAction, Adding_Graph_to_ChangeBondActions, Adding_MD_integration_tests, Adding_StructOpt_integration_tests, 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
- Children:
- e2a57d
- Parents:
- 318d5a
- git-author:
- Frederik Heber <heber@…> (02/08/17 21:37:21)
- git-committer:
- Frederik Heber <heber@…> (03/02/17 12:28:36)
- Location:
- ThirdParty/mpqc_open/src
- Files:
-
- 1 deleted
- 29 edited
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Makefile.am (modified) (1 diff)
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lib/chemistry/cca/Makefile.am (modified) (2 diffs)
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lib/chemistry/molecule/Makefile.am (modified) (3 diffs)
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lib/chemistry/qc/Makefile.am (deleted)
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lib/chemistry/qc/basis/Makefile.am (modified) (3 diffs)
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lib/chemistry/qc/cints/Makefile.am (modified) (3 diffs)
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lib/chemistry/qc/dft/Makefile.am (modified) (3 diffs)
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lib/chemistry/qc/intcca/Makefile.am (modified) (2 diffs)
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lib/chemistry/qc/intv3/Makefile.am (modified) (3 diffs)
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lib/chemistry/qc/mbpt/Makefile.am (modified) (3 diffs)
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lib/chemistry/qc/mbptr12/Makefile.am (modified) (3 diffs)
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lib/chemistry/qc/oint3/Makefile.am (modified) (2 diffs)
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lib/chemistry/qc/psi/Makefile.am (modified) (3 diffs)
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lib/chemistry/qc/scf/Makefile.am (modified) (3 diffs)
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lib/chemistry/qc/wfn/Makefile.am (modified) (3 diffs)
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lib/chemistry/solvent/Makefile.am (modified) (3 diffs)
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lib/math/isosurf/Makefile.am (modified) (3 diffs)
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lib/math/optimize/Makefile.am (modified) (3 diffs)
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lib/math/scmat/Makefile.am (modified) (3 diffs)
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lib/math/symmetry/Makefile.am (modified) (3 diffs)
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lib/util/class/Makefile.am (modified) (3 diffs)
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lib/util/container/Makefile.am (modified) (3 diffs)
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lib/util/group/Makefile.am (modified) (5 diffs)
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lib/util/keyval/Makefile.am (modified) (3 diffs)
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lib/util/misc/Makefile.am (modified) (3 diffs)
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lib/util/options/Makefile.am (modified) (3 diffs)
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lib/util/psi3/libpsio/Makefile.am (modified) (3 diffs)
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lib/util/ref/Makefile.am (modified) (3 diffs)
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lib/util/render/Makefile.am (modified) (3 diffs)
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lib/util/state/Makefile.am (modified) (3 diffs)
Legend:
- Unmodified
- Added
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ThirdParty/mpqc_open/src/Makefile.am
r318d5a r23612c 1 AM_CPPFLAGS = -I$(top_srcdir)/include -I$(top_srcdir)/src/lib2 3 1 LIBCAPITALNAMESOURCES = \ 4 2 LIBSOURCES -
ThirdParty/mpqc_open/src/lib/chemistry/cca/Makefile.am
r318d5a r23612c 1 1 LIBSCCCASOURCES = \ 2 basis_cca_to_sc.cc except.cc MPQC_Chemistry_Molecule_Impl.cc MPQC_Chemistry_MoleculeViewer_Impl.cc MPQC_ChemistryOpt_CoordinateModel_Impl.cc MPQC_Chemistry_QC_ModelFactory_Impl.cc MPQC_Chemistry_QC_Model_Impl.cc MPQC_ComponentClassDescription_Impl.cc MPQC_ComponentFactory_Impl.cc MPQC_GaussianBasis_Atomic_Impl.cc MPQC_GaussianBasis_Molecular_Impl.cc MPQC_GaussianBasis_Shell_Impl.cc MPQC_IntegralEvaluator2_Impl.cc MPQC_IntegralEvaluator3_Impl.cc MPQC_IntegralEvaluator4_Impl.cc MPQC_IntegralEvaluatorFactory_Impl.cc MPQC_Physics_Units_Impl.cc MPQC_SimpleDriver_Impl.cc socket.cc 2 chemistry/cca/basis_cca_to_sc.cc \ 3 chemistry/cca/except.cc \ 4 chemistry/cca/MPQC_Chemistry_Molecule_Impl.cc \ 5 chemistry/cca/MPQC_Chemistry_MoleculeViewer_Impl.cc \ 6 chemistry/cca/MPQC_ChemistryOpt_CoordinateModel_Impl.cc \ 7 chemistry/cca/MPQC_Chemistry_QC_ModelFactory_Impl.cc \ 8 chemistry/cca/MPQC_Chemistry_QC_Model_Impl.cc \ 9 chemistry/cca/MPQC_ComponentClassDescription_Impl.cc \ 10 chemistry/cca/MPQC_ComponentFactory_Impl.cc \ 11 chemistry/cca/MPQC_GaussianBasis_Atomic_Impl.cc \ 12 chemistry/cca/MPQC_GaussianBasis_Molecular_Impl.cc \ 13 chemistry/cca/MPQC_GaussianBasis_Shell_Impl.cc \ 14 chemistry/cca/MPQC_IntegralEvaluator2_Impl.cc \ 15 chemistry/cca/MPQC_IntegralEvaluator3_Impl.cc \ 16 chemistry/cca/MPQC_IntegralEvaluator4_Impl.cc \ 17 chemistry/cca/MPQC_IntegralEvaluatorFactory_Impl.cc \ 18 chemistry/cca/MPQC_Physics_Units_Impl.cc \ 19 chemistry/cca/MPQC_SimpleDriver_Impl.cc \ 20 chemistry/cca/socket.cc 21 3 22 4 23 LIBSCCCAHEADERS = \ 5 ccaiter.h except.h LIBS.h MPQC_Chemistry_Molecule_Impl.hh MPQC_Chemistry_MoleculeViewer_Impl.hh MPQC_ChemistryOpt_CoordinateModel_Impl.hh MPQC_Chemistry_QC_ModelFactory_Impl.hh MPQC_Chemistry_QC_Model_Impl.hh MPQC_ComponentClassDescription_Impl.hh MPQC_ComponentFactory_Impl.hh MPQC_GaussianBasis_Atomic_Impl.hh MPQC_GaussianBasis_Molecular_Impl.hh MPQC_GaussianBasis_Shell_Impl.hh MPQC_IntegralEvaluator2_Impl.hh MPQC_IntegralEvaluator3_Impl.hh MPQC_IntegralEvaluator4_Impl.hh MPQC_IntegralEvaluatorFactory_Impl.hh MPQC_Physics_Units_Impl.hh MPQC_SimpleDriver_Impl.hh socket.h 24 chemistry/cca/ccaiter.h \ 25 chemistry/cca/except.h \ 26 chemistry/cca/LIBS.h \ 27 chemistry/cca/MPQC_Chemistry_Molecule_Impl.hh \ 28 chemistry/cca/MPQC_Chemistry_MoleculeViewer_Impl.hh \ 29 chemistry/cca/MPQC_ChemistryOpt_CoordinateModel_Impl.hh \ 30 chemistry/cca/MPQC_Chemistry_QC_ModelFactory_Impl.hh \ 31 chemistry/cca/MPQC_Chemistry_QC_Model_Impl.hh \ 32 chemistry/cca/MPQC_ComponentClassDescription_Impl.hh \ 33 chemistry/cca/MPQC_ComponentFactory_Impl.hh \ 34 chemistry/cca/MPQC_GaussianBasis_Atomic_Impl.hh \ 35 chemistry/cca/MPQC_GaussianBasis_Molecular_Impl.hh \ 36 chemistry/cca/MPQC_GaussianBasis_Shell_Impl.hh \ 37 chemistry/cca/MPQC_IntegralEvaluator2_Impl.hh \ 38 chemistry/cca/MPQC_IntegralEvaluator3_Impl.hh \ 39 chemistry/cca/MPQC_IntegralEvaluator4_Impl.hh \ 40 chemistry/cca/MPQC_IntegralEvaluatorFactory_Impl.hh \ 41 chemistry/cca/MPQC_Physics_Units_Impl.hh \ 42 chemistry/cca/MPQC_SimpleDriver_Impl.hh \ 43 chemistry/cca/socket.h 44 6 45 7 46 lib_LTLIBRARIES += … … 43 82 #nodist_libSCcca_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 83 84 -
ThirdParty/mpqc_open/src/lib/chemistry/molecule/Makefile.am
r318d5a r23612c 1 1 LIBSCMOLECULESOURCES = \ 2 atominfo.cc bend.cc cartcoor.cc coor.cc energy.cc fdhess.cc formula.cc hess.cc imcoor.cc linip.cc linop.cc molecule.cc molfreq.cc molrender.cc molshape.cc molsymm.cc out.cc redund.cc simple.cc stors.cc stre.cc symmcoor.cc taylor.cc tors.cc 2 chemistry/molecule/atominfo.cc \ 3 chemistry/molecule/bend.cc \ 4 chemistry/molecule/cartcoor.cc \ 5 chemistry/molecule/coor.cc \ 6 chemistry/molecule/energy.cc \ 7 chemistry/molecule/fdhess.cc \ 8 chemistry/molecule/formula.cc \ 9 chemistry/molecule/hess.cc \ 10 chemistry/molecule/imcoor.cc \ 11 chemistry/molecule/linip.cc \ 12 chemistry/molecule/linop.cc \ 13 chemistry/molecule/molecule.cc \ 14 chemistry/molecule/molfreq.cc \ 15 chemistry/molecule/molrender.cc \ 16 chemistry/molecule/molshape.cc \ 17 chemistry/molecule/molsymm.cc \ 18 chemistry/molecule/out.cc \ 19 chemistry/molecule/redund.cc \ 20 chemistry/molecule/simple.cc \ 21 chemistry/molecule/stors.cc \ 22 chemistry/molecule/stre.cc \ 23 chemistry/molecule/symmcoor.cc \ 24 chemistry/molecule/taylor.cc \ 25 chemistry/molecule/tors.cc 26 3 27 4 28 LIBSCMOLECULEHEADERS = \ 5 atominfo.h coor.h energy.h fdhess.h formula.h hess.h linkage.h localdef.h molecule.h molfreq.h molrender.h molshape.h simple.h taylor.h 29 chemistry/molecule/atominfo.h \ 30 chemistry/molecule/coor.h \ 31 chemistry/molecule/energy.h \ 32 chemistry/molecule/fdhess.h \ 33 chemistry/molecule/formula.h \ 34 chemistry/molecule/hess.h \ 35 chemistry/molecule/linkage.h \ 36 chemistry/molecule/localdef.h \ 37 chemistry/molecule/molecule.h \ 38 chemistry/molecule/molfreq.h \ 39 chemistry/molecule/molrender.h \ 40 chemistry/molecule/molshape.h \ 41 chemistry/molecule/simple.h \ 42 chemistry/molecule/taylor.h 43 6 44 7 45 lib_LTLIBRARIES += … … 43 81 #nodist_libSCmolecule_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 82 83 45 84 MOLECULETESTS = \ 46 85 moltest \ … … 55 94 libSCcontainer.la libSCref.la libSCmisc.la 56 95 57 moltest_SOURCES = moltest.cc 96 moltest_SOURCES = \ 97 chemistry/molecule/moltest.cc 58 98 moltest_LDADD = \ 59 99 $(MOLECULELIBS) 60 100 61 symmetrize_SOURCES = symmetrize.cc 101 symmetrize_SOURCES = \ 102 chemistry/molecule/symmetrize.cc 62 103 symmetrize_LDADD = \ 63 104 $(MOLECULELIBS) -
ThirdParty/mpqc_open/src/lib/chemistry/qc/basis/Makefile.am
r318d5a r23612c 1 1 LIBSCBASISSOURCES = \ 2 aotoso.cc cartiter.cc dercent.cc distshpair.cc extent.cc files.cc gaussbas.cc gaussbaval.cc gaussshell.cc gaussshval.cc gpetite.cc integral.cc obint.cc orthog.cc petite.cc shellrot.cc sobasis.cc sointegral.cc symmint.cc tbint.cc transform.cc 2 chemistry/qc/basis/aotoso.cc \ 3 chemistry/qc/basis/cartiter.cc \ 4 chemistry/qc/basis/dercent.cc \ 5 chemistry/qc/basis/distshpair.cc \ 6 chemistry/qc/basis/extent.cc \ 7 chemistry/qc/basis/files.cc \ 8 chemistry/qc/basis/gaussbas.cc \ 9 chemistry/qc/basis/gaussbaval.cc \ 10 chemistry/qc/basis/gaussshell.cc \ 11 chemistry/qc/basis/gaussshval.cc \ 12 chemistry/qc/basis/gpetite.cc \ 13 chemistry/qc/basis/integral.cc \ 14 chemistry/qc/basis/obint.cc \ 15 chemistry/qc/basis/orthog.cc \ 16 chemistry/qc/basis/petite.cc \ 17 chemistry/qc/basis/shellrot.cc \ 18 chemistry/qc/basis/sobasis.cc \ 19 chemistry/qc/basis/sointegral.cc \ 20 chemistry/qc/basis/symmint.cc \ 21 chemistry/qc/basis/tbint.cc \ 22 chemistry/qc/basis/transform.cc 23 24 LIBSCBASISBUILTHEADERS = \ 25 chemistry/qc/basis/f77sym.h 3 26 4 27 LIBSCBASISHEADERS = \ 5 basis.h cartiter.h dercent.h distshpair.h extent.h files.h gaussbas.h gaussshell.h gpetite.h integral.h obint.h orthog.h petite.h shellrot.h sobasis.h sointegral.h symmint.h tbint.h transform.h 28 chemistry/qc/basis/basis.h \ 29 chemistry/qc/basis/cartiter.h \ 30 chemistry/qc/basis/dercent.h \ 31 chemistry/qc/basis/distshpair.h \ 32 chemistry/qc/basis/extent.h \ 33 chemistry/qc/basis/files.h \ 34 chemistry/qc/basis/gaussbas.h \ 35 chemistry/qc/basis/gaussshell.h \ 36 chemistry/qc/basis/gpetite.h \ 37 chemistry/qc/basis/integral.h \ 38 chemistry/qc/basis/obint.h \ 39 chemistry/qc/basis/orthog.h \ 40 chemistry/qc/basis/petite.h \ 41 chemistry/qc/basis/shellrot.h \ 42 chemistry/qc/basis/sobasis.h \ 43 chemistry/qc/basis/sointegral.h \ 44 chemistry/qc/basis/symmint.h \ 45 chemistry/qc/basis/tbint.h \ 46 chemistry/qc/basis/transform.h 47 6 48 7 49 lib_LTLIBRARIES += … … 43 85 #nodist_libSCbasis_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 86 87 45 88 BASISTESTS = \ 46 89 btest … … 54 97 libSCcontainer.la libSCref.la libSCmisc.la 55 98 56 btest_SOURCES = btest.cc 99 btest_SOURCES = \ 100 chemistry/qc/basis/btest.cc 57 101 btest_LDADD = \ 58 102 $(BASISLIBS) -
ThirdParty/mpqc_open/src/lib/chemistry/qc/cints/Makefile.am
r318d5a r23612c 1 1 LIBSCCINTSSOURCES = \ 2 cints.cc comp_eri.cc comp_grt.cc edipole.cc equadrupole.cc eri.cc fjt.cc grt.cc hcore.cc int1e.cc int2e.cc kinetic.cc nuclear.cc obintcints.cc obosrr.cc overlap.cc permute2e.cc primpairs.cc shellpairs.cc storage.cc tbintcints.cc tform.cc 2 chemistry/qc/cints/cints.cc \ 3 chemistry/qc/cints/comp_eri.cc \ 4 chemistry/qc/cints/comp_grt.cc \ 5 chemistry/qc/cints/edipole.cc \ 6 chemistry/qc/cints/equadrupole.cc \ 7 chemistry/qc/cints/eri.cc \ 8 chemistry/qc/cints/fjt.cc \ 9 chemistry/qc/cints/grt.cc \ 10 chemistry/qc/cints/hcore.cc \ 11 chemistry/qc/cints/int1e.cc \ 12 chemistry/qc/cints/int2e.cc \ 13 chemistry/qc/cints/kinetic.cc \ 14 chemistry/qc/cints/nuclear.cc \ 15 chemistry/qc/cints/obintcints.cc \ 16 chemistry/qc/cints/obosrr.cc \ 17 chemistry/qc/cints/overlap.cc \ 18 chemistry/qc/cints/permute2e.cc \ 19 chemistry/qc/cints/primpairs.cc \ 20 chemistry/qc/cints/shellpairs.cc \ 21 chemistry/qc/cints/storage.cc \ 22 chemistry/qc/cints/tbintcints.cc \ 23 chemistry/qc/cints/tform.cc 24 3 25 4 26 LIBSCCINTSHEADERS = \ 5 cartit.h cints.h eri.h eri_quartet_data.h fjt.h grt.h grt_quartet_data.h int1e.h int2e.h linkage.h macros.h obintcints.h primpairs.h shellpairs.h static.h storage.h tbintcints.h tform.h 27 chemistry/qc/cints/cartit.h \ 28 chemistry/qc/cints/cints.h \ 29 chemistry/qc/cints/eri.h \ 30 chemistry/qc/cints/eri_quartet_data.h \ 31 chemistry/qc/cints/fjt.h \ 32 chemistry/qc/cints/grt.h \ 33 chemistry/qc/cints/grt_quartet_data.h \ 34 chemistry/qc/cints/int1e.h \ 35 chemistry/qc/cints/int2e.h \ 36 chemistry/qc/cints/linkage.h \ 37 chemistry/qc/cints/macros.h \ 38 chemistry/qc/cints/obintcints.h \ 39 chemistry/qc/cints/primpairs.h \ 40 chemistry/qc/cints/shellpairs.h \ 41 chemistry/qc/cints/static.h \ 42 chemistry/qc/cints/storage.h \ 43 chemistry/qc/cints/tbintcints.h \ 44 chemistry/qc/cints/tform.h 45 6 46 7 47 lib_LTLIBRARIES += … … 43 83 #nodist_libSCcints_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 84 85 45 86 CINTSTESTS = \ 46 87 cintstest … … 54 95 libSCcontainer.la libSCref.la libSCmisc.la 55 96 56 cintstest_SOURCES = cintstest.cc 97 cintstest_SOURCES = \ 98 chemistry/qc/cints/cintstest.cc 57 99 cintstest_LDADD = \ 58 100 $(CINTSLIBS) -
ThirdParty/mpqc_open/src/lib/chemistry/qc/dft/Makefile.am
r318d5a r23612c 1 1 LIBSCDFTSOURCES = \ 2 clks.cc functional.cc hsosks.cc integrator.cc tmplinst.cc uks.cc 2 chemistry/qc/dft/clks.cc \ 3 chemistry/qc/dft/functional.cc \ 4 chemistry/qc/dft/hsosks.cc \ 5 chemistry/qc/dft/integrator.cc \ 6 chemistry/qc/dft/tmplinst.cc \ 7 chemistry/qc/dft/uks.cc 8 3 9 4 10 LIBSCDFTHEADERS = \ 5 clks.h clkstmpl.h functional.h hsosks.h hsoskstmpl.h integrator.h linkage.h uks.h ukstmpl.h 11 chemistry/qc/dft/clks.h \ 12 chemistry/qc/dft/clkstmpl.h \ 13 chemistry/qc/dft/functional.h \ 14 chemistry/qc/dft/hsosks.h \ 15 chemistry/qc/dft/hsoskstmpl.h \ 16 chemistry/qc/dft/integrator.h \ 17 chemistry/qc/dft/linkage.h \ 18 chemistry/qc/dft/uks.h \ 19 chemistry/qc/dft/ukstmpl.h 20 6 21 7 22 lib_LTLIBRARIES += … … 43 58 #nodist_libSCdft_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 59 60 45 61 DFTTESTS = \ 46 62 dfttest \ … … 55 71 libSCcontainer.la libSCref.la libSCmisc.la 56 72 57 dfttest_SOURCES = dfttest.cc 73 dfttest_SOURCES = \ 74 chemistry/qc/dft/dfttest.cc 58 75 dfttest_LDADD = \ 59 76 $(DFTLIBS) 60 77 61 lebedev_SOURCES = lebedev.cc 78 lebedev_SOURCES = \ 79 chemistry/qc/dft/lebedev.cc 62 80 lebedev_LDADD = \ 63 81 $(DFTLIBS) -
ThirdParty/mpqc_open/src/lib/chemistry/qc/intcca/Makefile.am
r318d5a r23612c 1 1 LIBSCINTCCASOURCES = \ 2 int1e.cc int2e.cc intcca.cc obintcca.cc tbintcca.cc 2 chemistry/qc/intcca/int1e.cc \ 3 chemistry/qc/intcca/int2e.cc \ 4 chemistry/qc/intcca/intcca.cc \ 5 chemistry/qc/intcca/obintcca.cc \ 6 chemistry/qc/intcca/tbintcca.cc 7 3 8 4 9 LIBSCINTCCAHEADERS = \ 5 cartit.h int1e.h int2e.h intcca.h LIBS.h linkage.h macros.h obintcca.h tbintcca.h tform.h 10 chemistry/qc/intcca/cartit.h \ 11 chemistry/qc/intcca/int1e.h \ 12 chemistry/qc/intcca/int2e.h \ 13 chemistry/qc/intcca/intcca.h \ 14 chemistry/qc/intcca/LIBS.h \ 15 chemistry/qc/intcca/linkage.h \ 16 chemistry/qc/intcca/macros.h \ 17 chemistry/qc/intcca/obintcca.h \ 18 chemistry/qc/intcca/tbintcca.h \ 19 chemistry/qc/intcca/tform.h 20 6 21 7 22 lib_LTLIBRARIES += … … 43 58 #nodist_libSCintcca_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 59 60 -
ThirdParty/mpqc_open/src/lib/chemistry/qc/intv3/Makefile.am
r318d5a r23612c 1 1 LIBSCINTV3SOURCES = \ 2 array.cc atominfo.cc bounds.cc build2e.cc comp1e.cc comp2e3c.cc comp2e.cc fjt.cc init2e.cc int1e.cc int2e.cc intv3.cc obintv3.cc offsets.cc print2e.cc shift2e.cc storage.cc store.cc tbintv3.cc tformv3.cc 2 chemistry/qc/intv3/array.cc \ 3 chemistry/qc/intv3/atominfo.cc \ 4 chemistry/qc/intv3/bounds.cc \ 5 chemistry/qc/intv3/build2e.cc \ 6 chemistry/qc/intv3/comp1e.cc \ 7 chemistry/qc/intv3/comp2e3c.cc \ 8 chemistry/qc/intv3/comp2e.cc \ 9 chemistry/qc/intv3/fjt.cc \ 10 chemistry/qc/intv3/init2e.cc \ 11 chemistry/qc/intv3/int1e.cc \ 12 chemistry/qc/intv3/int2e.cc \ 13 chemistry/qc/intv3/intv3.cc \ 14 chemistry/qc/intv3/obintv3.cc \ 15 chemistry/qc/intv3/offsets.cc \ 16 chemistry/qc/intv3/print2e.cc \ 17 chemistry/qc/intv3/shift2e.cc \ 18 chemistry/qc/intv3/storage.cc \ 19 chemistry/qc/intv3/store.cc \ 20 chemistry/qc/intv3/tbintv3.cc \ 21 chemistry/qc/intv3/tformv3.cc 3 22 4 23 LIBSCINTV3HEADERS = \ 5 array.h cartitv3.h fjt.h flags.h int1e.h int2e.h intv3.h macros.h obintv3.h storage.h tbintv3.h tformv3.h types.h utils.h 24 chemistry/qc/intv3/array.h \ 25 chemistry/qc/intv3/cartitv3.h \ 26 chemistry/qc/intv3/fjt.h \ 27 chemistry/qc/intv3/flags.h \ 28 chemistry/qc/intv3/int1e.h \ 29 chemistry/qc/intv3/int2e.h \ 30 chemistry/qc/intv3/intv3.h \ 31 chemistry/qc/intv3/macros.h \ 32 chemistry/qc/intv3/obintv3.h \ 33 chemistry/qc/intv3/storage.h \ 34 chemistry/qc/intv3/tbintv3.h \ 35 chemistry/qc/intv3/tformv3.h \ 36 chemistry/qc/intv3/types.h \ 37 chemistry/qc/intv3/utils.h 38 6 39 7 40 lib_LTLIBRARIES += … … 43 76 #nodist_libSCintv3_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 77 78 45 79 INTV3TESTS = \ 46 80 fjttest \ … … 55 89 libSCcontainer.la libSCref.la libSCmisc.la 56 90 57 fjttest_SOURCES = fjttest.cc 91 fjttest_SOURCES = \ 92 chemistry/qc/intv3/fjttest.cc 58 93 fjttest_LDADD = \ 59 94 $(INTV3LIBS) 60 95 61 inttest_SOURCES = inttest.cc 96 inttest_SOURCES = \ 97 chemistry/qc/intv3/inttest.cc 62 98 inttest_LDADD = \ 63 99 $(INTV3LIBS) -
ThirdParty/mpqc_open/src/lib/chemistry/qc/mbpt/Makefile.am
r318d5a r23612c 1 1 LIBSCMBPTSOURCES = \ 2 bzerofast.c cscphf.cc csgmat.cc csgrad34qb.cc csgrad.cc csgrade12.cc csgrads2pdm.cc hsosv1.cc hsosv1e1.cc hsosv2.cc hsosv2lb.cc mbpt.cc mp2extrap.cc util.cc 2 chemistry/qc/mbpt/bzerofast.c \ 3 chemistry/qc/mbpt/cscphf.cc \ 4 chemistry/qc/mbpt/csgmat.cc \ 5 chemistry/qc/mbpt/csgrad34qb.cc \ 6 chemistry/qc/mbpt/csgrad.cc \ 7 chemistry/qc/mbpt/csgrade12.cc \ 8 chemistry/qc/mbpt/csgrads2pdm.cc \ 9 chemistry/qc/mbpt/hsosv1.cc \ 10 chemistry/qc/mbpt/hsosv1e1.cc \ 11 chemistry/qc/mbpt/hsosv2.cc \ 12 chemistry/qc/mbpt/hsosv2lb.cc \ 13 chemistry/qc/mbpt/mbpt.cc \ 14 chemistry/qc/mbpt/mp2extrap.cc \ 15 chemistry/qc/mbpt/util.cc 16 3 17 4 18 LIBSCMBPTHEADERS = \ 5 bzerofast.h csgrad34qb.h csgrade12.h csgrads2pdm.h hsosv1e1.h linkage.h mbpt.h mp2extrap.h util.h 19 chemistry/qc/mbpt/bzerofast.h \ 20 chemistry/qc/mbpt/csgrad34qb.h \ 21 chemistry/qc/mbpt/csgrade12.h \ 22 chemistry/qc/mbpt/csgrads2pdm.h \ 23 chemistry/qc/mbpt/hsosv1e1.h \ 24 chemistry/qc/mbpt/linkage.h \ 25 chemistry/qc/mbpt/mbpt.h \ 26 chemistry/qc/mbpt/mp2extrap.h \ 27 chemistry/qc/mbpt/util.h 28 6 29 7 30 lib_LTLIBRARIES += … … 43 66 #nodist_libSCmbpt_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 67 68 45 69 MBPTTESTS = \ 46 70 mbpttest … … 54 78 libSCcontainer.la libSCref.la libSCmisc.la 55 79 56 mbpttest_SOURCES = mbpttest.cc 80 mbpttest_SOURCES = \ 81 chemistry/qc/mbpt/mbpttest.cc 57 82 mbpttest_LDADD = \ 58 83 $(MBPTLIBS) -
ThirdParty/mpqc_open/src/lib/chemistry/qc/mbptr12/Makefile.am
r318d5a r23612c 1 1 LIBSCMBPTR12SOURCES = \ 2 compute_a_gebc_abs1.cc compute_a_gebc.cc compute_a_gebc_vbs.cc compute_amps.cc compute_energy_a.cc compute_ijxy.cc compute_ikjy.cc compute_ixjy.cc compute_vxb_a_asymm.cc compute_vxb_a_symm.cc coulomb.cc dualbasis_mp2.cc ebc_contribs.cc exchange.cc fock.cc gbc_contribs.cc mbptr12.cc moindexspace.cc mp2r12_energy.cc multipole_ints.cc pairiter.cc r12_amps.cc r12ia.cc r12ia_memgrp.cc r12ia_mpiiofile.cc r12ia_node0file.cc r12int_eval.cc ri_basis.cc svd.cc transform_123inds.cc transform_12inds.cc transform_13inds.cc transform_factory.cc transform_ijxy.cc transform_ikjy.cc transform_ixjy.cc transform_tbint.cc twobodygrid.cc vxb_eval_info.cc 2 chemistry/qc/mbptr12/compute_a_gebc_abs1.cc \ 3 chemistry/qc/mbptr12/compute_a_gebc.cc \ 4 chemistry/qc/mbptr12/compute_a_gebc_vbs.cc \ 5 chemistry/qc/mbptr12/compute_amps.cc \ 6 chemistry/qc/mbptr12/compute_energy_a.cc \ 7 chemistry/qc/mbptr12/compute_ijxy.cc \ 8 chemistry/qc/mbptr12/compute_ikjy.cc \ 9 chemistry/qc/mbptr12/compute_ixjy.cc \ 10 chemistry/qc/mbptr12/compute_vxb_a_asymm.cc \ 11 chemistry/qc/mbptr12/compute_vxb_a_symm.cc \ 12 chemistry/qc/mbptr12/coulomb.cc \ 13 chemistry/qc/mbptr12/dualbasis_mp2.cc \ 14 chemistry/qc/mbptr12/ebc_contribs.cc \ 15 chemistry/qc/mbptr12/exchange.cc \ 16 chemistry/qc/mbptr12/fock.cc \ 17 chemistry/qc/mbptr12/gbc_contribs.cc \ 18 chemistry/qc/mbptr12/mbptr12.cc \ 19 chemistry/qc/mbptr12/moindexspace.cc \ 20 chemistry/qc/mbptr12/mp2r12_energy.cc \ 21 chemistry/qc/mbptr12/multipole_ints.cc \ 22 chemistry/qc/mbptr12/pairiter.cc \ 23 chemistry/qc/mbptr12/r12_amps.cc \ 24 chemistry/qc/mbptr12/r12ia.cc \ 25 chemistry/qc/mbptr12/r12ia_memgrp.cc \ 26 chemistry/qc/mbptr12/r12ia_mpiiofile.cc \ 27 chemistry/qc/mbptr12/r12ia_node0file.cc \ 28 chemistry/qc/mbptr12/r12int_eval.cc \ 29 chemistry/qc/mbptr12/ri_basis.cc \ 30 chemistry/qc/mbptr12/svd.cc \ 31 chemistry/qc/mbptr12/transform_123inds.cc \ 32 chemistry/qc/mbptr12/transform_12inds.cc \ 33 chemistry/qc/mbptr12/transform_13inds.cc \ 34 chemistry/qc/mbptr12/transform_factory.cc \ 35 chemistry/qc/mbptr12/transform_ijxy.cc \ 36 chemistry/qc/mbptr12/transform_ikjy.cc \ 37 chemistry/qc/mbptr12/transform_ixjy.cc \ 38 chemistry/qc/mbptr12/transform_tbint.cc \ 39 chemistry/qc/mbptr12/twobodygrid.cc \ 40 chemistry/qc/mbptr12/vxb_eval_info.cc 41 3 42 4 43 LIBSCMBPTR12HEADERS = \ 5 blas.h lapack.h linearr12.h linkage.h mbptr12.h moindexspace.h mp2r12_energy.h pairiter.h print_scmat_norms.h r12_amps.h r12ia.h r12ia_memgrp.h r12ia_mpiiofile.h r12ia_node0file.h r12int_eval.h svd.h transform_123inds.h transform_12inds.h transform_13inds.h transform_factory.h transform_ijxy.h transform_ikjy.h transform_ixjy.h transform_tbint.h twobodygrid.h vxb_eval_info.h 44 chemistry/qc/mbptr12/blas.h \ 45 chemistry/qc/mbptr12/lapack.h \ 46 chemistry/qc/mbptr12/linearr12.h \ 47 chemistry/qc/mbptr12/linkage.h \ 48 chemistry/qc/mbptr12/mbptr12.h \ 49 chemistry/qc/mbptr12/moindexspace.h \ 50 chemistry/qc/mbptr12/mp2r12_energy.h \ 51 chemistry/qc/mbptr12/pairiter.h \ 52 chemistry/qc/mbptr12/print_scmat_norms.h \ 53 chemistry/qc/mbptr12/r12_amps.h \ 54 chemistry/qc/mbptr12/r12ia.h \ 55 chemistry/qc/mbptr12/r12ia_memgrp.h \ 56 chemistry/qc/mbptr12/r12ia_mpiiofile.h \ 57 chemistry/qc/mbptr12/r12ia_node0file.h \ 58 chemistry/qc/mbptr12/r12int_eval.h \ 59 chemistry/qc/mbptr12/svd.h \ 60 chemistry/qc/mbptr12/transform_123inds.h \ 61 chemistry/qc/mbptr12/transform_12inds.h \ 62 chemistry/qc/mbptr12/transform_13inds.h \ 63 chemistry/qc/mbptr12/transform_factory.h \ 64 chemistry/qc/mbptr12/transform_ijxy.h \ 65 chemistry/qc/mbptr12/transform_ikjy.h \ 66 chemistry/qc/mbptr12/transform_ixjy.h \ 67 chemistry/qc/mbptr12/transform_tbint.h \ 68 chemistry/qc/mbptr12/twobodygrid.h \ 69 chemistry/qc/mbptr12/vxb_eval_info.h 70 6 71 7 72 lib_LTLIBRARIES += … … 43 108 #nodist_libSCmbptr12_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 109 110 45 111 MBPTR12TESTS = \ 46 112 mbptr12test … … 54 120 libSCcontainer.la libSCref.la libSCmisc.la 55 121 56 mbptr12test_SOURCES = mbptr12test.cc 122 mbptr12test_SOURCES = \ 123 chemistry/qc/mbptr12/mbptr12test.cc 57 124 mbptr12test_LDADD = \ 58 125 $(MBPTR12LIBS) -
ThirdParty/mpqc_open/src/lib/chemistry/qc/oint3/Makefile.am
r318d5a r23612c 1 1 LIBSCOINT3SOURCES = \ 2 build.cc i0100AB.cc i0100.cc i0101AB.cc i0101.cc i0111AB.cc i0111.cc i0200AB.cc i0200.cc i0201AB.cc i0201.cc i0202AB.cc i0202.cc i0211AB.cc i0211.cc i0212AB.cc i0212.cc i0222AB.cc i0222.cc i0300AB.cc i0300.cc i0301AB.cc i0301.cc i0302AB.cc i0302.cc i0303AB.cc i0303.cc i0311AB.cc i0311.cc i0312AB.cc i0312.cc i0313AB.cc i0313.cc i0322AB.cc i0322.cc i0323AB.cc i0323.cc i0333AB.cc i0333.cc i1100AB.cc i1100.cc i1111AB.cc i1111.cc i1200AB.cc i1200.cc i1201AB.cc i1201.cc i1211AB.cc i1211.cc i1212AB.cc i1212.cc i1222AB.cc i1222.cc i1300AB.cc i1300.cc i1301AB.cc i1301.cc i1302AB.cc i1302.cc i1311AB.cc i1311.cc i1312AB.cc i1312.cc i1313AB.cc i1313.cc i1322AB.cc i1322.cc i1323AB.cc i1323.cc i1333AB.cc i1333.cc i2200AB.cc i2200.cc i2201AB.cc i2201.cc i2211AB.cc i2211.cc i2222AB.cc i2222.cc i2300AB.cc i2300.cc i2301AB.cc i2301.cc i2302AB.cc i2302.cc i2311AB.cc i2311.cc i2312AB.cc i2312.cc i2322AB.cc i2322.cc i2323AB.cc i2323.cc i2333AB.cc i2333.cc i3300AB.cc i3300.cc i3301AB.cc i3301.cc i3302AB.cc i3302.cc i3311AB.cc i3311.cc i3312AB.cc i3312.cc i3322AB.cc i3322.cc i3333AB.cc i3333.cc 2 chemistry/qc/oint3/build.cc \ 3 chemistry/qc/oint3/i0100AB.cc \ 4 chemistry/qc/oint3/i0100.cc \ 5 chemistry/qc/oint3/i0101AB.cc \ 6 chemistry/qc/oint3/i0101.cc \ 7 chemistry/qc/oint3/i0111AB.cc \ 8 chemistry/qc/oint3/i0111.cc \ 9 chemistry/qc/oint3/i0200AB.cc \ 10 chemistry/qc/oint3/i0200.cc \ 11 chemistry/qc/oint3/i0201AB.cc \ 12 chemistry/qc/oint3/i0201.cc \ 13 chemistry/qc/oint3/i0202AB.cc \ 14 chemistry/qc/oint3/i0202.cc \ 15 chemistry/qc/oint3/i0211AB.cc \ 16 chemistry/qc/oint3/i0211.cc \ 17 chemistry/qc/oint3/i0212AB.cc \ 18 chemistry/qc/oint3/i0212.cc \ 19 chemistry/qc/oint3/i0222AB.cc \ 20 chemistry/qc/oint3/i0222.cc \ 21 chemistry/qc/oint3/i0300AB.cc \ 22 chemistry/qc/oint3/i0300.cc \ 23 chemistry/qc/oint3/i0301AB.cc \ 24 chemistry/qc/oint3/i0301.cc \ 25 chemistry/qc/oint3/i0302AB.cc \ 26 chemistry/qc/oint3/i0302.cc \ 27 chemistry/qc/oint3/i0303AB.cc \ 28 chemistry/qc/oint3/i0303.cc \ 29 chemistry/qc/oint3/i0311AB.cc \ 30 chemistry/qc/oint3/i0311.cc \ 31 chemistry/qc/oint3/i0312AB.cc \ 32 chemistry/qc/oint3/i0312.cc \ 33 chemistry/qc/oint3/i0313AB.cc \ 34 chemistry/qc/oint3/i0313.cc \ 35 chemistry/qc/oint3/i0322AB.cc \ 36 chemistry/qc/oint3/i0322.cc \ 37 chemistry/qc/oint3/i0323AB.cc \ 38 chemistry/qc/oint3/i0323.cc \ 39 chemistry/qc/oint3/i0333AB.cc \ 40 chemistry/qc/oint3/i0333.cc \ 41 chemistry/qc/oint3/i1100AB.cc \ 42 chemistry/qc/oint3/i1100.cc \ 43 chemistry/qc/oint3/i1111AB.cc \ 44 chemistry/qc/oint3/i1111.cc \ 45 chemistry/qc/oint3/i1200AB.cc \ 46 chemistry/qc/oint3/i1200.cc \ 47 chemistry/qc/oint3/i1201AB.cc \ 48 chemistry/qc/oint3/i1201.cc \ 49 chemistry/qc/oint3/i1211AB.cc \ 50 chemistry/qc/oint3/i1211.cc \ 51 chemistry/qc/oint3/i1212AB.cc \ 52 chemistry/qc/oint3/i1212.cc \ 53 chemistry/qc/oint3/i1222AB.cc \ 54 chemistry/qc/oint3/i1222.cc \ 55 chemistry/qc/oint3/i1300AB.cc \ 56 chemistry/qc/oint3/i1300.cc \ 57 chemistry/qc/oint3/i1301AB.cc \ 58 chemistry/qc/oint3/i1301.cc \ 59 chemistry/qc/oint3/i1302AB.cc \ 60 chemistry/qc/oint3/i1302.cc \ 61 chemistry/qc/oint3/i1311AB.cc \ 62 chemistry/qc/oint3/i1311.cc \ 63 chemistry/qc/oint3/i1312AB.cc \ 64 chemistry/qc/oint3/i1312.cc \ 65 chemistry/qc/oint3/i1313AB.cc \ 66 chemistry/qc/oint3/i1313.cc \ 67 chemistry/qc/oint3/i1322AB.cc \ 68 chemistry/qc/oint3/i1322.cc \ 69 chemistry/qc/oint3/i1323AB.cc \ 70 chemistry/qc/oint3/i1323.cc \ 71 chemistry/qc/oint3/i1333AB.cc \ 72 chemistry/qc/oint3/i1333.cc \ 73 chemistry/qc/oint3/i2200AB.cc \ 74 chemistry/qc/oint3/i2200.cc \ 75 chemistry/qc/oint3/i2201AB.cc \ 76 chemistry/qc/oint3/i2201.cc \ 77 chemistry/qc/oint3/i2211AB.cc \ 78 chemistry/qc/oint3/i2211.cc \ 79 chemistry/qc/oint3/i2222AB.cc \ 80 chemistry/qc/oint3/i2222.cc \ 81 chemistry/qc/oint3/i2300AB.cc \ 82 chemistry/qc/oint3/i2300.cc \ 83 chemistry/qc/oint3/i2301AB.cc \ 84 chemistry/qc/oint3/i2301.cc \ 85 chemistry/qc/oint3/i2302AB.cc \ 86 chemistry/qc/oint3/i2302.cc \ 87 chemistry/qc/oint3/i2311AB.cc \ 88 chemistry/qc/oint3/i2311.cc \ 89 chemistry/qc/oint3/i2312AB.cc \ 90 chemistry/qc/oint3/i2312.cc \ 91 chemistry/qc/oint3/i2322AB.cc \ 92 chemistry/qc/oint3/i2322.cc \ 93 chemistry/qc/oint3/i2323AB.cc \ 94 chemistry/qc/oint3/i2323.cc \ 95 chemistry/qc/oint3/i2333AB.cc \ 96 chemistry/qc/oint3/i2333.cc \ 97 chemistry/qc/oint3/i3300AB.cc \ 98 chemistry/qc/oint3/i3300.cc \ 99 chemistry/qc/oint3/i3301AB.cc \ 100 chemistry/qc/oint3/i3301.cc \ 101 chemistry/qc/oint3/i3302AB.cc \ 102 chemistry/qc/oint3/i3302.cc \ 103 chemistry/qc/oint3/i3311AB.cc \ 104 chemistry/qc/oint3/i3311.cc \ 105 chemistry/qc/oint3/i3312AB.cc \ 106 chemistry/qc/oint3/i3312.cc \ 107 chemistry/qc/oint3/i3322AB.cc \ 108 chemistry/qc/oint3/i3322.cc \ 109 chemistry/qc/oint3/i3333AB.cc \ 110 chemistry/qc/oint3/i3333.cc 111 3 112 4 113 LIBSCOINT3HEADERS = \ 5 build.h LIBS.h 114 chemistry/qc/oint3/build.h 115 6 116 7 117 lib_LTLIBRARIES += … … 43 153 #nodist_libSCoint3_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 154 155 -
ThirdParty/mpqc_open/src/lib/chemistry/qc/psi/Makefile.am
r318d5a r23612c 1 1 LIBSCPSISOURCES = \ 2 psiexenv.cc psifile11.cc psiinput.cc psiwfn.cc 2 chemistry/qc/psi/psiexenv.cc \ 3 chemistry/qc/psi/psifile11.cc \ 4 chemistry/qc/psi/psiinput.cc \ 5 chemistry/qc/psi/psiwfn.cc 6 3 7 4 8 LIBSCPSIHEADERS = \ 5 linkage.h psiexenv.h psifile11.h psiinput.h psiwfn.h 9 chemistry/qc/psi/linkage.h \ 10 chemistry/qc/psi/psiexenv.h \ 11 chemistry/qc/psi/psifile11.h \ 12 chemistry/qc/psi/psiinput.h \ 13 chemistry/qc/psi/psiwfn.h 14 6 15 7 16 lib_LTLIBRARIES += … … 43 52 #nodist_libSCpsi_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 53 54 45 55 PSITESTS = \ 46 56 psitest … … 54 64 libSCcontainer.la libSCref.la libSCmisc.la 55 65 56 psitest_SOURCES = psitest.cc 66 psitest_SOURCES = \ 67 chemistry/qc/psi/psitest.cc 57 68 psitest_LDADD = \ 58 69 $(PSILIBS) -
ThirdParty/mpqc_open/src/lib/chemistry/qc/scf/Makefile.am
r318d5a r23612c 1 1 LIBSCSCFSOURCES = \ 2 clhf.cc clscf.cc effh.cc hsoshf.cc hsosscf.cc osshf.cc ossscf.cc scf.cc scfgradient.cc scfops.cc scfvector.cc svd.cc tchf.cc tcscf.cc tmplinst.cc uhf.cc uscf.cc 2 chemistry/qc/scf/clhf.cc \ 3 chemistry/qc/scf/clscf.cc \ 4 chemistry/qc/scf/effh.cc \ 5 chemistry/qc/scf/hsoshf.cc \ 6 chemistry/qc/scf/hsosscf.cc \ 7 chemistry/qc/scf/osshf.cc \ 8 chemistry/qc/scf/ossscf.cc \ 9 chemistry/qc/scf/scf.cc \ 10 chemistry/qc/scf/scfgradient.cc \ 11 chemistry/qc/scf/scfops.cc \ 12 chemistry/qc/scf/scfvector.cc \ 13 chemistry/qc/scf/svd.cc \ 14 chemistry/qc/scf/tchf.cc \ 15 chemistry/qc/scf/tcscf.cc \ 16 chemistry/qc/scf/tmplinst.cc \ 17 chemistry/qc/scf/uhf.cc \ 18 chemistry/qc/scf/uscf.cc 19 3 20 4 21 LIBSCSCFHEADERS = \ 5 clhf.h clhftmpl.h clscf.h effh.h gbuild.h hsoshf.h hsoshftmpl.h hsosscf.h lbgbuild.h lgbuild.h linkage.h ltbgrad.h osshf.h osshftmpl.h ossscf.h scf.h scflocal.h scfops.h tbgrad.h tchf.h tchftmpl.h tcscf.h uhf.h uhftmpl.h uscf.h 22 chemistry/qc/scf/clhf.h \ 23 chemistry/qc/scf/clhftmpl.h \ 24 chemistry/qc/scf/clscf.h \ 25 chemistry/qc/scf/effh.h \ 26 chemistry/qc/scf/gbuild.h \ 27 chemistry/qc/scf/hsoshf.h \ 28 chemistry/qc/scf/hsoshftmpl.h \ 29 chemistry/qc/scf/hsosscf.h \ 30 chemistry/qc/scf/lbgbuild.h \ 31 chemistry/qc/scf/lgbuild.h \ 32 chemistry/qc/scf/linkage.h \ 33 chemistry/qc/scf/ltbgrad.h \ 34 chemistry/qc/scf/osshf.h \ 35 chemistry/qc/scf/osshftmpl.h \ 36 chemistry/qc/scf/ossscf.h \ 37 chemistry/qc/scf/scf.h \ 38 chemistry/qc/scf/scflocal.h \ 39 chemistry/qc/scf/scfops.h \ 40 chemistry/qc/scf/tbgrad.h \ 41 chemistry/qc/scf/tchf.h \ 42 chemistry/qc/scf/tchftmpl.h \ 43 chemistry/qc/scf/tcscf.h \ 44 chemistry/qc/scf/uhf.h \ 45 chemistry/qc/scf/uhftmpl.h \ 46 chemistry/qc/scf/uscf.h 47 6 48 7 49 lib_LTLIBRARIES += … … 43 85 #nodist_libSCscf_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 86 87 45 88 SCFTESTS = \ 46 89 scftest … … 54 97 libSCcontainer.la libSCref.la libSCmisc.la 55 98 56 scftest_SOURCES = scftest.cc 99 scftest_SOURCES = \ 100 chemistry/qc/scf/scftest.cc 57 101 scftest_LDADD = \ 58 102 $(SCFLIBS) -
ThirdParty/mpqc_open/src/lib/chemistry/qc/wfn/Makefile.am
r318d5a r23612c 1 1 LIBSCWFNSOURCES = \ 2 accum.cc density.cc densval.cc eht.cc hcorewfn.cc nao.cc natorbval.cc obwfn.cc orbital.cc solvent.cc wfn.cc 2 chemistry/qc/wfn/accum.cc \ 3 chemistry/qc/wfn/density.cc \ 4 chemistry/qc/wfn/densval.cc \ 5 chemistry/qc/wfn/eht.cc \ 6 chemistry/qc/wfn/hcorewfn.cc \ 7 chemistry/qc/wfn/nao.cc \ 8 chemistry/qc/wfn/natorbval.cc \ 9 chemistry/qc/wfn/obwfn.cc \ 10 chemistry/qc/wfn/orbital.cc \ 11 chemistry/qc/wfn/solvent.cc \ 12 chemistry/qc/wfn/wfn.cc 13 3 14 4 15 LIBSCWFNHEADERS = \ 5 accum.h density.h eht.h linkage.h obwfn.h orbital.h solvent.h wfn.h 16 chemistry/qc/wfn/accum.h \ 17 chemistry/qc/wfn/density.h \ 18 chemistry/qc/wfn/eht.h \ 19 chemistry/qc/wfn/linkage.h \ 20 chemistry/qc/wfn/obwfn.h \ 21 chemistry/qc/wfn/orbital.h \ 22 chemistry/qc/wfn/solvent.h \ 23 chemistry/qc/wfn/wfn.h 24 6 25 7 26 lib_LTLIBRARIES += … … 43 62 #nodist_libSCwfn_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 63 64 45 65 WFNTESTS = \ 46 66 wfntest … … 54 74 libSCcontainer.la libSCref.la libSCmisc.la 55 75 56 wfntest_SOURCES = wfntest.cc 76 wfntest_SOURCES = \ 77 chemistry/qc/wfn/wfntest.cc 57 78 wfntest_LDADD = \ 58 79 $(WFNLIBS) -
ThirdParty/mpqc_open/src/lib/chemistry/solvent/Makefile.am
r318d5a r23612c 1 1 LIBSCSOLVENTSOURCES = \ 2 bem.cc disprep.cc 2 chemistry/solvent/bem.cc \ 3 chemistry/solvent/disprep.cc 4 3 5 4 6 LIBSCSOLVENTHEADERS = \ 5 bem.h 7 chemistry/solvent/bem.h 8 6 9 7 10 lib_LTLIBRARIES += … … 43 46 #nodist_libSCsolvent_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 47 48 45 49 SOLVENTTESTS = \ 46 50 bemtest … … 54 58 libSCcontainer.la libSCref.la libSCmisc.la 55 59 56 bemtest_SOURCES = bemtest.cc 60 bemtest_SOURCES = \ 61 chemistry/solvent/bemtest.cc 57 62 bemtest_LDADD = \ 58 63 $(SOLVENTLIBS) -
ThirdParty/mpqc_open/src/lib/math/isosurf/Makefile.am
r318d5a r23612c 1 1 LIBSCISOSURFSOURCES = \ 2 edge.cc implicit.c isosurf.cc shape.cc surf.cc surfor.cc surfse.cc surfst.cc triangle.cc tricoef.cc vertex.cc volume.cc volume_i.cc 2 math/isosurf/edge.cc \ 3 math/isosurf/implicit.c \ 4 math/isosurf/isosurf.cc \ 5 math/isosurf/shape.cc \ 6 math/isosurf/surf.cc \ 7 math/isosurf/surfor.cc \ 8 math/isosurf/surfse.cc \ 9 math/isosurf/surfst.cc \ 10 math/isosurf/triangle.cc \ 11 math/isosurf/tricoef.cc \ 12 math/isosurf/vertex.cc \ 13 math/isosurf/volume.cc \ 14 math/isosurf/volume_i.cc 15 3 16 4 17 LIBSCISOSURFHEADERS = \ 5 edge.h implicit.h isosurf.h shape.h surf.h triangle.h tricoef.h vertex.h volume.h volume_i.h 18 math/isosurf/edge.h \ 19 math/isosurf/implicit.h \ 20 math/isosurf/isosurf.h \ 21 math/isosurf/shape.h \ 22 math/isosurf/surf.h \ 23 math/isosurf/triangle.h \ 24 math/isosurf/tricoef.h \ 25 math/isosurf/vertex.h \ 26 math/isosurf/volume.h \ 27 math/isosurf/volume_i.h 28 6 29 7 30 lib_LTLIBRARIES += … … 43 66 #nodist_libSCisosurf_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 67 68 45 69 ISOSURFTESTS = \ 46 70 tmplinst \ … … 55 79 libSCcontainer.la libSCref.la libSCmisc.la 56 80 57 tmplinst_SOURCES = tmplinst.cc 81 tmplinst_SOURCES = \ 82 math/isosurf/tmplinst.cc 58 83 tmplinst_LDADD = \ 59 84 $(ISOSURFLIBS) 60 85 61 isotest_SOURCES = isotest.cc 86 isotest_SOURCES = \ 87 math/isosurf/isotest.cc 62 88 isotest_LDADD = \ 63 89 $(ISOSURFLIBS) -
ThirdParty/mpqc_open/src/lib/math/optimize/Makefile.am
r318d5a r23612c 1 1 LIBSCOPTIMIZESOURCES = \ 2 conv.cc dfp.cc diis.cc efc.cc function.cc gdiis.cc mcsearch.cc newton.cc opt.cc powell.cc qnewton.cc scextrap.cc scextrapmat.cc steep.cc transform.cc update.cc 2 math/optimize/conv.cc \ 3 math/optimize/dfp.cc \ 4 math/optimize/diis.cc \ 5 math/optimize/efc.cc \ 6 math/optimize/function.cc \ 7 math/optimize/gdiis.cc \ 8 math/optimize/mcsearch.cc \ 9 math/optimize/newton.cc \ 10 math/optimize/opt.cc \ 11 math/optimize/powell.cc \ 12 math/optimize/qnewton.cc \ 13 math/optimize/scextrap.cc \ 14 math/optimize/scextrapmat.cc \ 15 math/optimize/steep.cc \ 16 math/optimize/transform.cc \ 17 math/optimize/update.cc 18 3 19 4 20 LIBSCOPTIMIZEHEADERS = \ 5 conv.h diis.h efc.h function.h gdiis.h linkage.h mcsearch.h newton.h opt.h qnewton.h scextrap.h scextrapmat.h steep.h transform.h update.h 21 math/optimize/conv.h \ 22 math/optimize/diis.h \ 23 math/optimize/efc.h \ 24 math/optimize/function.h \ 25 math/optimize/gdiis.h \ 26 math/optimize/linkage.h \ 27 math/optimize/mcsearch.h \ 28 math/optimize/newton.h \ 29 math/optimize/opt.h \ 30 math/optimize/qnewton.h \ 31 math/optimize/scextrap.h \ 32 math/optimize/scextrapmat.h \ 33 math/optimize/steep.h \ 34 math/optimize/transform.h \ 35 math/optimize/update.h 36 6 37 7 38 lib_LTLIBRARIES += … … 43 74 #nodist_libSCoptimize_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 75 76 45 77 OPTIMIZETESTS = \ 46 78 opttest \ … … 56 88 libSCcontainer.la libSCref.la libSCmisc.la 57 89 58 opttest_SOURCES = opttest.cc 90 opttest_SOURCES = \ 91 math/optimize/opttest.cc 59 92 opttest_LDADD = \ 60 93 $(OPTIMIZELIBS) 61 94 62 scextest_optimize_SOURCES = scextest.cc 95 scextest_optimize_SOURCES = \ 96 math/optimize/scextest.cc 63 97 scextest_optimize_LDADD = \ 64 98 $(OPTIMIZELIBS) 65 99 66 kvopt_SOURCES = kvopt.cc 100 kvopt_SOURCES = \ 101 math/optimize/kvopt.cc 67 102 kvopt_LDADD = \ 68 103 $(OPTIMIZELIBS) -
ThirdParty/mpqc_open/src/lib/math/scmat/Makefile.am
r318d5a r23612c 1 1 LIBSCSCMATSOURCES = \ 2 abstract.cc blkiter.cc block.cc blocked.cc blockeddiag.cc blockedrect.cc blockedsymm.cc blockedvect.cc cmatrix.c dim.cc dist.cc distdiag.cc disthql.cc distrect.cc distsymm.cc distvect.cc elemop.cc local.cc localdiag.cc localrect.cc localsymm.cc localvect.cc matrix3.cc matrix.cc matrix_i.cc repl.cc repldiag.cc replrect.cc replsymm.cc replvect.cc result.cc svd.c util.cc vector3.cc vector3_i.cc 2 math/scmat/abstract.cc \ 3 math/scmat/blkiter.cc \ 4 math/scmat/block.cc \ 5 math/scmat/blocked.cc \ 6 math/scmat/blockeddiag.cc \ 7 math/scmat/blockedrect.cc \ 8 math/scmat/blockedsymm.cc \ 9 math/scmat/blockedvect.cc \ 10 math/scmat/cmatrix.c \ 11 math/scmat/dim.cc \ 12 math/scmat/dist.cc \ 13 math/scmat/distdiag.cc \ 14 math/scmat/disthql.cc \ 15 math/scmat/distrect.cc \ 16 math/scmat/distsymm.cc \ 17 math/scmat/distvect.cc \ 18 math/scmat/elemop.cc \ 19 math/scmat/local.cc \ 20 math/scmat/localdiag.cc \ 21 math/scmat/localrect.cc \ 22 math/scmat/localsymm.cc \ 23 math/scmat/localvect.cc \ 24 math/scmat/matrix3.cc \ 25 math/scmat/matrix.cc \ 26 math/scmat/matrix_i.cc \ 27 math/scmat/repl.cc \ 28 math/scmat/repldiag.cc \ 29 math/scmat/replrect.cc \ 30 math/scmat/replsymm.cc \ 31 math/scmat/replvect.cc \ 32 math/scmat/result.cc \ 33 math/scmat/svd.c \ 34 math/scmat/util.cc \ 35 math/scmat/vector3.cc \ 36 math/scmat/vector3_i.cc 37 3 38 4 39 LIBSCSCMATHEADERS = \ 5 abstract.h blkiter.h blocked.h block.h cmatrix.h dim.h dist.h disthql.h elemop.h linkage.h local.h matrix3.h matrix.h matrix_i.h mops.h offset.h repl.h result.h util.h vector3.h vector3_i.h 40 math/scmat/abstract.h \ 41 math/scmat/blkiter.h \ 42 math/scmat/blocked.h \ 43 math/scmat/block.h \ 44 math/scmat/cmatrix.h \ 45 math/scmat/dim.h \ 46 math/scmat/dist.h \ 47 math/scmat/disthql.h \ 48 math/scmat/elemop.h \ 49 math/scmat/linkage.h \ 50 math/scmat/local.h \ 51 math/scmat/matrix3.h \ 52 math/scmat/matrix.h \ 53 math/scmat/matrix_i.h \ 54 math/scmat/mops.h \ 55 math/scmat/offset.h \ 56 math/scmat/repl.h \ 57 math/scmat/result.h \ 58 math/scmat/util.h \ 59 math/scmat/vector3.h \ 60 math/scmat/vector3_i.h 61 6 62 7 63 lib_LTLIBRARIES += … … 43 99 #nodist_libSCscmat_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 100 101 45 102 SCMATTESTS = \ 46 103 localtest \ … … 57 114 libSCcontainer.la libSCref.la libSCmisc.la 58 115 59 localtest_SOURCES = localtest.cc 116 localtest_SOURCES = \ 117 math/scmat/localtest.cc 60 118 localtest_LDADD = \ 61 119 $(SCMATLIBS) 62 120 63 repltest_SOURCES = repltest.cc 121 repltest_SOURCES = \ 122 math/scmat/repltest.cc 64 123 repltest_LDADD = \ 65 124 $(SCMATLIBS) 66 125 67 disttest_SOURCES = disttest.cc 126 disttest_SOURCES = \ 127 math/scmat/disttest.cc 68 128 disttest_LDADD = \ 69 129 $(SCMATLIBS) 70 130 71 blockedtest_SOURCES = blockedtest.cc 131 blockedtest_SOURCES = \ 132 math/scmat/blockedtest.cc 72 133 blockedtest_LDADD = \ 73 134 $(SCMATLIBS) -
ThirdParty/mpqc_open/src/lib/math/symmetry/Makefile.am
r318d5a r23612c 1 1 LIBSCSYMMETRYSOURCES = \ 2 chartab.cc corrtab.cc ico.cc irrep.cc maketab.cc pointgrp.cc rep.cc symop.cc tetra.cc 2 math/symmetry/chartab.cc \ 3 math/symmetry/corrtab.cc \ 4 math/symmetry/ico.cc \ 5 math/symmetry/irrep.cc \ 6 math/symmetry/maketab.cc \ 7 math/symmetry/pointgrp.cc \ 8 math/symmetry/rep.cc \ 9 math/symmetry/symop.cc \ 10 math/symmetry/tetra.cc 11 3 12 4 13 LIBSCSYMMETRYHEADERS = \ 5 corrtab.h pointgrp.h 14 math/symmetry/corrtab.h \ 15 math/symmetry/pointgrp.h 16 6 17 7 18 lib_LTLIBRARIES += … … 43 54 #nodist_libSCsymmetry_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 55 56 45 57 SYMMETRYTESTS = \ 46 58 testpg … … 54 66 libSCcontainer.la libSCref.la libSCmisc.la 55 67 56 testpg_SOURCES = testpg.cc 68 testpg_SOURCES = \ 69 math/symmetry/testpg.cc 57 70 testpg_LDADD = \ 58 71 $(SYMMETRYLIBS) -
ThirdParty/mpqc_open/src/lib/util/class/Makefile.am
r318d5a r23612c 1 1 LIBSCCLASSSOURCES = \ 2 class.cc scexception.cc 2 util/class/class.cc \ 3 util/class/scexception.cc 4 3 5 4 6 LIBSCCLASSHEADERS = \ 5 class.h proxy.h scexception.h 7 util/class/class.h \ 8 util/class/proxy.h \ 9 util/class/scexception.h 10 6 11 7 12 lib_LTLIBRARIES += … … 43 48 #nodist_libSCclass_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 49 50 45 51 CLASSTESTS = \ 46 52 classtest \ … … 53 59 libSCclass.la libSCcontainer.la libSCref.la libSCmisc.la libSCstate.la libSCkeyval.la 54 60 55 classtest_SOURCES = class.cc class.h classtest.cc 61 classtest_SOURCES = \ 62 util/class/class.cc \ 63 util/class/class.h \ 64 util/class/classtest.cc 56 65 classtest_LDADD = $(CLASSLIBS) 57 66 58 scextest_class_SOURCES = scextest.cc 67 scextest_class_SOURCES = \ 68 util/class/scextest.cc 59 69 scextest_class_LDADD = $(CLASSLIBS) 60 70 -
ThirdParty/mpqc_open/src/lib/util/container/Makefile.am
r318d5a r23612c 1 1 LIBSCCONTAINERSOURCES = \ 2 avl.cc bitarray.cc carray.cc 2 util/container/avl.cc \ 3 util/container/bitarray.cc \ 4 util/container/carray.cc 5 3 6 4 7 LIBSCCONTAINERHEADERS = \ 5 avlmap.h avlset.h bitarray.h carray.h compare.h eavlmmap.h LIBS.h 8 util/container/avlmap.h \ 9 util/container/avlset.h \ 10 util/container/bitarray.h \ 11 util/container/carray.h \ 12 util/container/compare.h \ 13 util/container/eavlmmap.h 14 6 15 7 16 lib_LTLIBRARIES += … … 43 52 #nodist_libSCcontainer_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 53 54 45 55 CONTAINERTESTS = \ 46 56 avltest … … 52 62 libSCmisc.la libSCkeyval.la libSCstate.la libSCclass.la libSCref.la libSCcontainer.la 53 63 54 avltest_SOURCES = avltest.cc 64 avltest_SOURCES = \ 65 util/container/avltest.cc 66 55 67 avltest_LDADD = $(CONTAINERLIBS) -
ThirdParty/mpqc_open/src/lib/util/group/Makefile.am
r318d5a r23612c 1 1 LIBSCGROUPSOURCES = \ 2 message.cc messimpl.cc messproc.cc messint.cc \ 3 reduce.cc topology.cc hcube.cc \ 4 rnglock.cc memory.cc memmsg.cc pool.cc \ 5 memamsg.cc memproc.cc \ 6 pregtime.cc thread.cc memiter.cc memrdma.cc 7 8 # file.cc fileproc.cc globcnt.cc hcube.cc memamsg.cc memarmci.cc memiter.cc memmsg.cc memmtmpi.cc memory.cc memproc.cc memrdma.cc memshm.cc message.cc messimpl.cc messint.cc messmpi.cc messproc.cc messshm.cc mstate.cc pool.cc pregtime.cc reduce.cc rnglock.cc thpthd.cc thpuma.cc thread.cc topology.cc 2 util/group/message.cc \ 3 util/group/messimpl.cc \ 4 util/group/messproc.cc \ 5 util/group/messint.cc \ 6 util/group/reduce.cc \ 7 util/group/topology.cc \ 8 util/group/hcube.cc \ 9 util/group/rnglock.cc \ 10 util/group/memory.cc \ 11 util/group/memmsg.cc \ 12 util/group/pool.cc \ 13 util/group/memamsg.cc \ 14 util/group/memproc.cc \ 15 util/group/pregtime.cc \ 16 util/group/thread.cc \ 17 util/group/memiter.cc \ 18 util/group/memrdma.cc 19 20 # util/group/file.cc \ 21 # util/group/fileproc.cc \ 22 # util/group/globcnt.cc \ 23 # util/group/hcube.cc \ 24 # util/group/memamsg.cc \ 25 # util/group/memarmci.cc \ 26 # util/group/memiter.cc \ 27 # util/group/memmsg.cc \ 28 # util/group/memmtmpi.cc \ 29 # util/group/memory.cc \ 30 # util/group/memproc.cc \ 31 # util/group/memrdma.cc \ 32 # util/group/memshm.cc \ 33 # util/group/message.cc \ 34 # util/group/messimpl.cc \ 35 # util/group/messint.cc \ 36 # util/group/messmpi.cc \ 37 # util/group/messproc.cc \ 38 # util/group/messshm.cc \ 39 # util/group/mstate.cc \ 40 # util/group/pool.cc \ 41 # util/group/pregtime.cc \ 42 # util/group/reduce.cc \ 43 # util/group/rnglock.cc \ 44 # util/group/thpthd.cc \ 45 # util/group/thpuma.cc \ 46 # util/group/thread.cc \ 47 # util/group/topology.cc 48 9 49 10 50 LIBSCGROUPHEADERS = \ 11 message.h \ 12 topology.h hcube.h \ 13 rnglock.h memory.h memmsg.h pool.h \ 14 memamsg.h memproc.h \ 15 pregtime.h thread.h memiter.h memrdma.h 16 51 util/group/message.h \ 52 util/group/topology.h \ 53 util/group/hcube.h \ 54 util/group/rnglock.h \ 55 util/group/memory.h \ 56 util/group/memmsg.h \ 57 util/group/pool.h \ 58 util/group/memamsg.h \ 59 util/group/memproc.h \ 60 util/group/pregtime.h \ 61 util/group/thread.h \ 62 util/group/memiter.h \ 63 util/group/memrdma.h 17 64 18 # file.h fileproc.h globcnt.h hcube.h LIBS.h linkage.h memamsg.h memarmci.h memiter.h memmsg.h memmtmpi.h memory.h memproc.h memrdma.h memshm.h message.h messaget.h messmpi.h messshm.h mstate.h pool.h pregtime.h rnglock.h thpthd.h thpuma.h thread.h topology.h 65 # util/group/file.h \ 66 # util/group/fileproc.h \ 67 # util/group/globcnt.h \ 68 # util/group/hcube.h \ 69 # util/group/LIBS.h \ 70 # util/group/linkage.h \ 71 # util/group/memamsg.h \ 72 # util/group/memarmci.h \ 73 # util/group/memiter.h \ 74 # util/group/memmsg.h \ 75 # util/group/memmtmpi.h \ 76 # util/group/memory.h \ 77 # util/group/memproc.h \ 78 # util/group/memrdma.h \ 79 # util/group/memshm.h \ 80 # util/group/message.h \ 81 # util/group/messaget.h \ 82 # util/group/messmpi.h \ 83 # util/group/messshm.h \ 84 # util/group/mstate.h \ 85 # util/group/pool.h \ 86 # util/group/pregtime.h \ 87 # util/group/rnglock.h \ 88 # util/group/thpthd.h \ 89 # util/group/thpuma.h \ 90 # util/group/thread.h \ 91 # util/group/topology.h 92 19 93 20 94 lib_LTLIBRARIES += … … 56 130 #nodist_libSCgroup_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 57 131 132 58 133 GROUPTESTS = \ 59 134 memtest \ … … 76 151 libSCref.la 77 152 78 memtest_SOURCES = memtest.cc 153 memtest_SOURCES = \ 154 util/group/memtest.cc 79 155 memtest_LDADD = \ 80 156 libSCgroup.la \ … … 86 162 libSCref.la 87 163 88 messtest_SOURCES = messtest.cc 164 messtest_SOURCES = \ 165 util/group/messtest.cc 89 166 messtest_LDADD = \ 90 167 libSCgroup.la \ … … 96 173 libSCref.la 97 174 98 pooltest_SOURCES = pooltest.cc 175 pooltest_SOURCES = \ 176 util/group/pooltest.cc 99 177 pooltest_LDADD = \ 100 178 $(GROUPLIBS) 101 179 102 prttest_SOURCES = prttest.cc 180 prttest_SOURCES = \ 181 util/group/prttest.cc 103 182 prttest_LDADD = \ 104 183 $(GROUPLIBS) 105 184 106 rnglocktest_SOURCES = rnglocktest.cc 185 rnglocktest_SOURCES = \ 186 util/group/rnglocktest.cc 107 187 rnglocktest_LDADD = \ 108 188 libSCmisc.la libSCgroup.la 109 189 110 thrtest_SOURCES = thrtest.cc 190 thrtest_SOURCES = \ 191 util/group/thrtest.cc 111 192 thrtest_LDADD = \ 112 193 libSCgroup.la \ -
ThirdParty/mpqc_open/src/lib/util/keyval/Makefile.am
r318d5a r23612c 1 1 LIBSCKEYVALSOURCES = \ 2 ipv2_alloc.cc ipv2.cc ipv2_cwk.cc ipv2_data.cc ipv2_error.cc ipv2_karray.cc ipv2_parse.cc ipv2_print.cc ipv2_read.cc ipv2_scan.cc keyvalagg.cc keyvalass.cc keyval.cc keyvalipv2.cc keyvalpre.cc keyvalstr.cc keyvalval.cc 2 util/keyval/ipv2_alloc.cc \ 3 util/keyval/ipv2.cc \ 4 util/keyval/ipv2_cwk.cc \ 5 util/keyval/ipv2_data.cc \ 6 util/keyval/ipv2_error.cc \ 7 util/keyval/ipv2_karray.cc \ 8 util/keyval/ipv2_parse.cc \ 9 util/keyval/ipv2_print.cc \ 10 util/keyval/ipv2_read.cc \ 11 util/keyval/ipv2_scan.cc \ 12 util/keyval/keyvalagg.cc \ 13 util/keyval/keyvalass.cc \ 14 util/keyval/keyval.cc \ 15 util/keyval/keyvalipv2.cc \ 16 util/keyval/keyvalpre.cc \ 17 util/keyval/keyvalstr.cc \ 18 util/keyval/keyvalval.cc 19 3 20 4 21 LIBSCKEYVALHEADERS = \ 5 ipv2.h ipv2_parse.h ipv2_scan.h keyval.h keyvalval.h LIBS.h 22 util/keyval/ipv2.h \ 23 util/keyval/ipv2_parse.h \ 24 util/keyval/ipv2_scan.h \ 25 util/keyval/keyval.h \ 26 util/keyval/keyvalval.h 27 6 28 7 29 lib_LTLIBRARIES += … … 43 65 #nodist_libSCkeyval_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 66 67 45 68 KEYVALTESTS = \ 46 69 keyvaltest … … 58 81 libSCref.la 59 82 60 keyvaltest_SOURCES = keyvaltest.cc 83 keyvaltest_SOURCES = \ 84 util/keyval/keyvaltest.cc 85 61 86 keyvaltest_LDADD = \ 62 87 $(KEYVALLIBS) -
ThirdParty/mpqc_open/src/lib/util/misc/Makefile.am
r318d5a r23612c 1 1 LIBSCMISCSOURCES = \ 2 bug.cc compute.cc exenv.cc formio.cc ieee.cc regtime.cc units.cc 3 # ccaenv.cc 2 util/misc/bug.cc \ 3 util/misc/compute.cc \ 4 util/misc/exenv.cc \ 5 util/misc/formio.cc \ 6 util/misc/ieee.cc \ 7 util/misc/regtime.cc \ 8 util/misc/units.cc 9 10 # util/misc/ccaenv.cc 11 4 12 5 13 LIBSCMISCHEADERS = \ 6 timer.h compute.h ieee.h bug.h exenv.h 7 # autovec.h bug.h ccaenv.h comptmpl.h compute.h exenv.h formio.h ieee.h LIBS.h math.h newstring.h regtime.h scint.h string.h timer.h units.h 14 util/misc/timer.h \ 15 util/misc/compute.h \ 16 util/misc/ieee.h \ 17 util/misc/bug.h \ 18 util/misc/exenv.h 19 20 # util/misc/autovec.h \ 21 # util/misc/bug.h \ 22 # util/misc/ccaenv.h \ 23 # util/misc/comptmpl.h \ 24 # util/misc/compute.h \ 25 # util/misc/exenv.h \ 26 # util/misc/formio.h \ 27 # util/misc/ieee.h \ 28 # util/misc/LIBS.h \ 29 # util/misc/math.h \ 30 # util/misc/newstring.h \ 31 # util/misc/regtime.h \ 32 # util/misc/scint.h \ 33 # util/misc/string.h \ 34 # util/misc/timer.h \ 35 # util/misc/units.h 36 8 37 9 38 lib_LTLIBRARIES += … … 45 74 #nodist_libSCmisc_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 46 75 76 47 77 MISCTESTS = \ 48 78 autovectest \ … … 60 90 MISCLIBS = 61 91 62 autovectest_SOURCES = autovectest.cc 92 autovectest_SOURCES = \ 93 util/misc/autovectest.cc 63 94 autovectest_LDADD = \ 64 95 $(MISCLIBS) 65 96 66 comptest_SOURCES = comptest.cc 97 comptest_SOURCES = \ 98 util/misc/comptest.cc 67 99 comptest_LDADD = \ 68 100 $(MISCLIBS) 69 101 70 tregtime_SOURCES = tregtime.cc 102 tregtime_SOURCES = \ 103 util/misc/tregtime.cc 71 104 tregtime_LDADD = \ 72 105 $(MISCLIBS) 73 106 74 scinttest_SOURCES = scinttest.cc 107 scinttest_SOURCES = \ 108 util/misc/scinttest.cc 75 109 scinttest_LDADD = \ 76 110 $(MISCLIBS) 77 111 78 bugtest_SOURCES = bugtest.cc 112 bugtest_SOURCES = \ 113 util/misc/bugtest.cc 79 114 bugtest_LDADD = \ 80 115 $(MISCLIBS) 81 116 82 scextest_misc_SOURCES = scextest.cc 117 scextest_misc_SOURCES = \ 118 util/misc/scextest.cc 83 119 scextest_misc_LDADD = \ 84 120 $(MISCLIBS) 85 121 86 unittest_SOURCES = unittest.cc 122 unittest_SOURCES = \ 123 util/misc/unittest.cc 87 124 unittest_LDADD = \ 88 125 $(MISCLIBS) 89 126 90 formiot_SOURCES = formiot.cc 127 formiot_SOURCES = \ 128 util/misc/formiot.cc 91 129 formiot_LDADD = \ 92 130 $(MISCLIBS) -
ThirdParty/mpqc_open/src/lib/util/options/Makefile.am
r318d5a r23612c 1 1 LIBSCOPTIONSSOURCES = \ 2 GetLongOpt.cc 2 util/options/GetLongOpt.cc 3 3 4 4 5 LIBSCOPTIONSHEADERS = \ 5 GetLongOpt.h 6 util/options/GetLongOpt.h 7 6 8 7 9 lib_LTLIBRARIES += … … 43 45 #nodist_libSCoptions_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 46 47 45 48 OPTIONSTESTS = \ 46 49 sample … … 52 55 libSCoptions.la 53 56 54 sample_SOURCES = README.cc 57 sample_SOURCES = \ 58 util/options/README.cc 59 55 60 sample_LDADD = \ 56 61 $(OPTIONSLIBS) -
ThirdParty/mpqc_open/src/lib/util/psi3/libpsio/Makefile.am
r318d5a r23612c 1 1 LIBSCLIBPSIOSOURCES = \ 2 init.cc done.cc open.cc close.cc open_check.cc error.cc \ 3 rw.cc read.cc write.cc \ 4 tocwrite.cc tocread.cc tocscan.cc toclast.cc tocdel.cc tocclean.cc tocprint.cc \ 5 get_filename.cc get_numvols.cc get_volpath.cc volseek.cc get_address.cc get_global_address.cc \ 6 write_entry.cc read_entry.cc write_block.cc read_block.cc 7 # close.cc done.cc error.cc get_address.cc get_filename.cc get_global_address.cc get_numvols.cc get_volpath.cc init.cc open.cc open_check.cc psiotest.cc read_block.cc read.cc read_entry.cc rw.cc tocclean.cc tocdel.cc toclast.cc tocprint.cc tocread.cc tocscan.cc tocwrite.cc volseek.cc write_block.cc write.cc write_entry.cc 2 util/psi3/libpsio/init.cc \ 3 util/psi3/libpsio/done.cc \ 4 util/psi3/libpsio/open.cc \ 5 util/psi3/libpsio/close.cc \ 6 util/psi3/libpsio/open_check.cc \ 7 util/psi3/libpsio/error.cc \ 8 util/psi3/libpsio/rw.cc \ 9 util/psi3/libpsio/read.cc \ 10 util/psi3/libpsio/write.cc \ 11 util/psi3/libpsio/tocwrite.cc \ 12 util/psi3/libpsio/tocread.cc \ 13 util/psi3/libpsio/tocscan.cc \ 14 util/psi3/libpsio/toclast.cc \ 15 util/psi3/libpsio/tocdel.cc \ 16 util/psi3/libpsio/tocclean.cc \ 17 util/psi3/libpsio/tocprint.cc \ 18 util/psi3/libpsio/get_filename.cc \ 19 util/psi3/libpsio/get_numvols.cc \ 20 util/psi3/libpsio/get_volpath.cc \ 21 util/psi3/libpsio/volseek.cc \ 22 util/psi3/libpsio/get_address.cc \ 23 util/psi3/libpsio/get_global_address.cc \ 24 util/psi3/libpsio/write_entry.cc \ 25 util/psi3/libpsio/read_entry.cc \ 26 util/psi3/libpsio/write_block.cc \ 27 util/psi3/libpsio/read_block.cc 28 29 # util/psi3/libpsio/close.cc \ 30 # util/psi3/libpsio/done.cc \ 31 # util/psi3/libpsio/error.cc \ 32 # util/psi3/libpsio/get_address.cc \ 33 # util/psi3/libpsio/get_filename.cc \ 34 # util/psi3/libpsio/get_global_address.cc \ 35 # util/psi3/libpsio/get_numvols.cc \ 36 # util/psi3/libpsio/get_volpath.cc \ 37 # util/psi3/libpsio/init.cc \ 38 # util/psi3/libpsio/open.cc \ 39 # util/psi3/libpsio/open_check.cc \ 40 # util/psi3/libpsio/psiotest.cc \ 41 # util/psi3/libpsio/read_block.cc \ 42 # util/psi3/libpsio/read.cc \ 43 # util/psi3/libpsio/read_entry.cc \ 44 # util/psi3/libpsio/rw.cc \ 45 # util/psi3/libpsio/tocclean.cc \ 46 # util/psi3/libpsio/tocdel.cc \ 47 # util/psi3/libpsio/toclast.cc \ 48 # util/psi3/libpsio/tocprint.cc \ 49 # util/psi3/libpsio/tocread.cc \ 50 # util/psi3/libpsio/tocscan.cc \ 51 # util/psi3/libpsio/tocwrite.cc \ 52 # util/psi3/libpsio/volseek.cc \ 53 # util/psi3/libpsio/write_block.cc \ 54 # util/psi3/libpsio/write.cc \ 55 # util/psi3/libpsio/write_entry.cc 56 8 57 9 58 LIBSCLIBPSIOHEADERS = \ 10 psio.h psio.gbl 11 # psifiles.h psio.h 59 util/psi3/libpsio/psio.h \ 60 util/psi3/libpsio/psio.gbl 61 62 # util/psi3/libpsio/psifiles.h \ 63 # util/psi3/libpsio/psio.h 64 12 65 13 66 lib_LTLIBRARIES += … … 49 102 #nodist_libSCpsio_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 50 103 104 51 105 PSIOTESTS = \ 52 106 psiotest … … 58 112 libSCpsio.la libSCclass.la libSCcontainer.la libSCref.la libSCmisc.la libSCstate.la libSCkeyval.la 59 113 60 psiotest_SOURCES = psiotest.cc 114 psiotest_SOURCES = \ 115 util/psi3/libpsio/psiotest.cc 61 116 psiotest_LDADD = \ 62 117 $(PSIOLIBS) -
ThirdParty/mpqc_open/src/lib/util/ref/Makefile.am
r318d5a r23612c 1 1 LIBSCREFSOURCES = \ 2 identity.cc ref.cc 2 util/ref/identity.cc \ 3 util/ref/ref.cc 4 3 5 4 6 LIBSCREFHEADERS = \ 5 identity.h ref.h 7 util/ref/identity.h \ 8 util/ref/ref.h 9 6 10 7 11 lib_LTLIBRARIES += … … 43 47 #nodist_libSCref_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 48 49 45 50 REFTESTS = \ 46 51 reftest … … 54 59 libSCcontainer.la libSCref.la libSCmisc.la 55 60 56 reftest_SOURCES = reftest.cc reftextx.cc reftextx.h 61 reftest_SOURCES = \ 62 util/ref/reftest.cc \ 63 util/ref/reftextx.cc \ 64 util/ref/reftextx.h 65 57 66 reftest_LDADD = \ 58 67 $(REFLIBS) -
ThirdParty/mpqc_open/src/lib/util/render/Makefile.am
r318d5a r23612c 1 1 LIBSCRENDERSOURCES = \ 2 algebra3.cc animate.cc appearance.cc color.cc material.cc object.cc oogl.cc polygons.cc polylines.cc polysphere.cc render.cc sphere.cc tempinst.cc transform.cc 2 util/render/algebra3.cc \ 3 util/render/animate.cc \ 4 util/render/appearance.cc \ 5 util/render/color.cc \ 6 util/render/material.cc \ 7 util/render/object.cc \ 8 util/render/oogl.cc \ 9 util/render/polygons.cc \ 10 util/render/polylines.cc \ 11 util/render/polysphere.cc \ 12 util/render/render.cc \ 13 util/render/sphere.cc \ 14 util/render/tempinst.cc \ 15 util/render/transform.cc 16 3 17 4 18 LIBSCRENDERHEADERS = \ 5 algebra3.h animate.h appearance.h color.h find.h linkage.h material.h object.h oogl.h parameter.h polygons.h polylines.h polysphere.h render.h sphere.h stack.h transform.h 19 util/render/algebra3.h \ 20 util/render/animate.h \ 21 util/render/appearance.h \ 22 util/render/color.h \ 23 util/render/find.h \ 24 util/render/linkage.h \ 25 util/render/material.h \ 26 util/render/object.h \ 27 util/render/oogl.h \ 28 util/render/parameter.h \ 29 util/render/polygons.h \ 30 util/render/polylines.h \ 31 util/render/polysphere.h \ 32 util/render/render.h \ 33 util/render/sphere.h \ 34 util/render/stack.h \ 35 util/render/transform.h 36 6 37 7 38 lib_LTLIBRARIES += … … 43 74 #nodist_libSCrender_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 75 76 45 77 RENDERTESTS = \ 46 78 rentest … … 54 86 libSCcontainer.la libSCref.la libSCmisc.la 55 87 56 rentest_SOURCES = rentest.cc 88 rentest_SOURCES = \ 89 util/render/rentest.cc 57 90 rentest_LDADD = \ 58 91 $(RENDERLIBS) -
ThirdParty/mpqc_open/src/lib/util/state/Makefile.am
r318d5a r23612c 1 1 LIBSCSTATESOURCES = \ 2 proxy.cc state_bin.cc state.cc state_file.cc statein.cc stateout.cc state_text.cc tmplinst.cc translate.cc 2 util/state/proxy.cc \ 3 util/state/state_bin.cc \ 4 util/state/state.cc \ 5 util/state/state_file.cc \ 6 util/state/statein.cc \ 7 util/state/stateout.cc \ 8 util/state/state_text.cc \ 9 util/state/tmplinst.cc \ 10 util/state/translate.cc 11 3 12 4 13 LIBSCSTATEHEADERS = \ 5 linkage.h proxy.h state_bin.h state_file.h state.h statein.h stateio.h stateout.h state_text.h translate.h 14 util/state/linkage.h \ 15 util/state/proxy.h \ 16 util/state/state_bin.h \ 17 util/state/state_file.h \ 18 util/state/state.h \ 19 util/state/statein.h \ 20 util/state/stateio.h \ 21 util/state/stateout.h \ 22 util/state/state_text.h \ 23 util/state/translate.h 24 6 25 7 26 lib_LTLIBRARIES += … … 43 62 #nodist_libSCstate_libinclude_HEADERS = $(top_builddir)/src/lib/scconfig.h 44 63 64 45 65 STATETESTS = \ 46 66 statetest … … 54 74 libSCcontainer.la libSCref.la libSCmisc.la 55 75 56 statetest_SOURCES = statetest.cc 76 statetest_SOURCES = \ 77 util/state/statetest.cc 78 57 79 statetest_LDADD = \ 58 80 $(STATELIBS)
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