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Maho Nakata 0ada2aeeb5 Update to 2.3.1. 
* documents are now generated with doxygen.
* sort pkg-plist.
* build with libint; now supports some r12 methods.
2007-01-02 22:14:41 +00:00

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MAN1= \
mpqc.1 \
mpqcrun.1 \
scls.1 \
scpr.1 \
molrender.1 \
sc-config.1 \
sc-libtool.1 \
sc-mkf77sym.1
MAN3= \
sc_AtomInfo.3 \
sc_IntCoor.3 \
sc_SumIntCoor.3 \
sc_SetIntCoor.3 \
sc_IntCoorGen.3 \
sc_MolecularCoor.3 \
sc_IntMolecularCoor.3 \
sc_SymmMolecularCoor.3 \
sc_RedundMolecularCoor.3 \
sc_CartMolecularCoor.3 \
sc_MolecularEnergy.3 \
sc_FinDispMolecularHessian.3 \
sc_MolecularFormula.3 \
sc_MolecularHessian.3 \
sc_ReadMolecularHessian.3 \
sc_GuessMolecularHessian.3 \
sc_DiagMolecularHessian.3 \
sc_Molecule.3 \
sc_MolecularFrequencies.3 \
sc_VDWShape.3 \
sc_DiscreteConnollyShape.3 \
sc_ConnollyShape.3 \
sc_SimpleCo.3 \
sc_StreSimpleCo.3 \
sc_BendSimpleCo.3 \
sc_TorsSimpleCo.3 \
sc_ScaledTorsSimpleCo.3 \
sc_LinIPSimpleCo.3 \
sc_LinOPSimpleCo.3 \
sc_CartesianIter.3 \
sc_RedundantCartesianIter.3 \
sc_RedundantCartesianSubIter.3 \
sc_DerivCenters.3 \
sc_DistShellPair.3 \
sc_DistShellPair_SharedData.3 \
sc_GaussianBasisSet.3 \
sc_GaussianBasisSet_ValueData.3 \
sc_GaussianShell.3 \
sc_canonical_aaaa.3 \
sc_canonical_aabc.3 \
sc_canonical_aabb.3 \
sc_canonical_abcd.3 \
sc_GenPetite4.3 \
sc_GPetite4.3 \
sc_Integral.3 \
sc_OneBodyInt.3 \
sc_OneBodyOneCenterInt.3 \
sc_OneBodyDerivInt.3 \
sc_OneBodyOneCenterDerivInt.3 \
sc_OverlapOrthog.3 \
sc_ShellRotation.3 \
sc_SOTransformFunction.3 \
sc_SOTransformShell.3 \
sc_SOTransform.3 \
sc_SOBasis.3 \
sc_TwoBodyInt.3 \
sc_TwoBodyThreeCenterInt.3 \
sc_TwoBodyTwoCenterInt.3 \
sc_TwoBodyDerivInt.3 \
sc_TwoBodyThreeCenterDerivInt.3 \
sc_TwoBodyTwoCenterDerivInt.3 \
sc_SphericalTransformComponent.3 \
sc_SphericalTransform.3 \
sc_ISphericalTransform.3 \
sc_SphericalTransformIter.3 \
sc_IntegralCints.3 \
sc_EriCints.3 \
sc_GRTCints.3 \
sc_Int1eCints.3 \
sc_Int2eCints.3 \
sc_OneBodyIntCints.3 \
sc_PrimPairsCints.3 \
sc_ShellPairCints.3 \
sc_ShellPairsCints.3 \
sc_TwoBodyIntCints.3 \
sc_TwoBodyDerivIntCints.3 \
sc_CLKS.3 \
sc_PointInputData.3 \
sc_PointOutputData.3 \
sc_DenFunctional.3 \
sc_NElFunctional.3 \
sc_SumDenFunctional.3 \
sc_StdDenFunctional.3 \
sc_LSDACFunctional.3 \
sc_PBECFunctional.3 \
sc_PW91CFunctional.3 \
sc_P86CFunctional.3 \
sc_SlaterXFunctional.3 \
sc_VWNLCFunctional.3 \
sc_VWN1LCFunctional.3 \
sc_VWN2LCFunctional.3 \
sc_VWN3LCFunctional.3 \
sc_VWN4LCFunctional.3 \
sc_VWN5LCFunctional.3 \
sc_PW92LCFunctional.3 \
sc_PZ81LCFunctional.3 \
sc_XalphaFunctional.3 \
sc_Becke88XFunctional.3 \
sc_LYPCFunctional.3 \
sc_PW86XFunctional.3 \
sc_PBEXFunctional.3 \
sc_PW91XFunctional.3 \
sc_mPW91XFunctional.3 \
sc_G96XFunctional.3 \
sc_HSOSKS.3 \
sc_DenIntegrator.3 \
sc_IntegrationWeight.3 \
sc_BeckeIntegrationWeight.3 \
sc_RadialIntegrator.3 \
sc_AngularIntegrator.3 \
sc_EulerMaclaurinRadialIntegrator.3 \
sc_LebedevLaikovIntegrator.3 \
sc_GaussLegendreAngularIntegrator.3 \
sc_RadialAngularIntegrator.3 \
sc_UKS.3 \
sc_Int1eCCA.3 \
sc_Int2eCCA.3 \
sc_IntegralCCA.3 \
sc_OneBodyIntCCA.3 \
sc_OneBodyDerivIntCCA.3 \
sc_TwoBodyIntCCA.3 \
sc_TwoBodyDerivIntCCA.3 \
sc_Int1eV3.3 \
sc_Int2eV3.3 \
sc_IntegralV3.3 \
sc_OneBodyIntV3.3 \
sc_OneBodyDerivIntV3.3 \
sc_TwoBodyIntV3.3 \
sc_TwoBodyThreeCenterIntV3.3 \
sc_TwoBodyTwoCenterIntV3.3 \
sc_TwoBodyDerivIntV3.3 \
sc_MBPT2.3 \
sc_MBPT2_R12.3 \
sc_MOIndexSpace.3 \
sc_MP2R12Energy.3 \
sc_MOPairIter.3 \
sc_SpatialMOPairIter.3 \
sc_SpatialMOPairIter_eq.3 \
sc_SpatialMOPairIter_neq.3 \
sc_MOPairIterFactory.3 \
sc_R12Amplitudes.3 \
sc_R12IntsAcc.3 \
sc_R12IntEval.3 \
sc_MOIntsTransformFactory.3 \
sc_TwoBodyMOIntsTransform_ijxy.3 \
sc_TwoBodyMOIntsTransform_ikjy.3 \
sc_TwoBodyMOIntsTransform_ixjy.3 \
sc_TwoBodyGrid.3 \
sc_TwoBodyMOIntsTransform.3 \
sc_TwoBodyMOIntsTransform_MOSpaces.3 \
sc_R12IntEvalInfo.3 \
sc_PsiExEnv.3 \
sc_PsiFile11.3 \
sc_PsiInput.3 \
sc_PsiWavefunction.3 \
sc_PsiSCF.3 \
sc_PsiCLHF.3 \
sc_PsiHSOSHF.3 \
sc_PsiUHF.3 \
sc_PsiCCSD.3 \
sc_PsiCCSD_T.3 \
sc_CLHF.3 \
sc_CLSCF.3 \
sc_HSOSHF.3 \
sc_HSOSSCF.3 \
sc_SCF.3 \
sc_UHF.3 \
sc_UnrestrictedSCF.3 \
sc_ElectronDensity.3 \
sc_BatchElectronDensity.3 \
sc_OneBodyWavefunction.3 \
sc_Wavefunction.3 \
sc_Shape.3 \
sc_UnionShape.3 \
sc_Volume.3 \
sc_Convergence.3 \
sc_DIIS.3 \
sc_EFCOpt.3 \
sc_Function.3 \
sc_MCSearch.3 \
sc_Optimize.3 \
sc_LineOpt.3 \
sc_QNewtonOpt.3 \
sc_SCExtrapData.3 \
sc_SCExtrapError.3 \
sc_SelfConsistentExtrapolation.3 \
sc_HessianUpdate.3 \
sc_NonlinearTransform.3 \
sc_IdentityTransform.3 \
sc_DFPUpdate.3 \
sc_BFGSUpdate.3 \
sc_PowellUpdate.3 \
sc_SCMatrixKit.3 \
sc_SCVector.3 \
sc_SCMatrix.3 \
sc_SymmSCMatrix.3 \
sc_DiagSCMatrix.3 \
sc_SCMatrixBlockIter.3 \
sc_SCMatrixBlock.3 \
sc_SCVectorSimpleBlock.3 \
sc_SCVectorSimpleSubBlock.3 \
sc_SCMatrixRectBlock.3 \
sc_SCMatrixRectSubBlock.3 \
sc_SCMatrixLTriBlock.3 \
sc_SCMatrixLTriSubBlock.3 \
sc_SCMatrixDiagBlock.3 \
sc_SCMatrixDiagSubBlock.3 \
sc_SCMatrixSubblockIter.3 \
sc_SCBlockInfo.3 \
sc_SCDimension.3 \
sc_RefSCDimension.3 \
sc_DistSCMatrixKit.3 \
sc_SCElementOp.3 \
sc_SCElementOp2.3 \
sc_SCElementOp3.3 \
sc_SCElementKNorm.3 \
sc_LocalSCMatrixKit.3 \
sc_RefSCVector.3 \
sc_RefSCMatrix.3 \
sc_RefSymmSCMatrix.3 \
sc_SymRep.3 \
sc_RefDiagSCMatrix.3 \
sc_ReplSCMatrixKit.3 \
sc_CorrelationTable.3 \
sc_SymmetryOperation.3 \
sc_IrreducibleRepresentation.3 \
sc_CharacterTable.3 \
sc_PointGroup.3 \
sc_ParentClass.3 \
sc_ParentClasses.3 \
sc_ClassDesc.3 \
sc_DescribedClass.3 \
sc_ForceLinkBase.3 \
sc_ForceLink.3 \
sc_SCException.3 \
sc_ProgrammingError.3 \
sc_FeatureNotImplemented.3 \
sc_InputError.3 \
sc_SystemException.3 \
sc_MemAllocFailed.3 \
sc_FileOperationFailed.3 \
sc_SyscallFailed.3 \
sc_AlgorithmException.3 \
sc_MaxIterExceeded.3 \
sc_ToleranceExceeded.3 \
sc_LimitExceeded.3 \
sc_FileGrp.3 \
sc_ProcFileGrp.3 \
sc_ActiveMsgMemoryGrp.3 \
sc_ARMCIMemoryGrp.3 \
sc_MsgMemoryGrp.3 \
sc_MTMPIMemoryGrp.3 \
sc_MemoryGrp.3 \
sc_MemoryGrpBuf.3 \
sc_ProcMemoryGrp.3 \
sc_RDMAMemoryGrp.3 \
sc_ShmMemoryGrp.3 \
sc_MessageGrp.3 \
sc_ProcMessageGrp.3 \
sc_intMessageGrp.3 \
sc_MPIMessageGrp.3 \
sc_ShmMessageGrp.3 \
sc_MsgStateSend.3 \
sc_MsgStateBufRecv.3 \
sc_MsgStateRecv.3 \
sc_StateSend.3 \
sc_StateRecv.3 \
sc_BcastStateSend.3 \
sc_BcastStateRecv.3 \
sc_BcastState.3 \
sc_BcastStateInBin.3 \
sc_PthreadThreadGrp.3 \
sc_PumaThreadGrp.3 \
sc_ThreadLock.3 \
sc_ThreadLockHolder.3 \
sc_Thread.3 \
sc_ThreadGrp.3 \
sc_ProcThreadGrp.3 \
sc_KeyVal.3 \
sc_AssignedKeyVal.3 \
sc_StringKeyVal.3 \
sc_AggregateKeyVal.3 \
sc_PrefixKeyVal.3 \
sc_ParsedKeyVal.3 \
sc_auto_vec.3 \
sc_Debugger.3 \
sc_CCAEnv.3 \
sc_Result.3 \
sc_NCResult.3 \
sc_AccResult.3 \
sc_SSAccResult.3 \
sc_NCAccResult.3 \
sc_Compute.3 \
sc_ResultInfo.3 \
sc_AccResultInfo.3 \
sc_ExEnv.3 \
sc_SCFormIO.3 \
sc_scprintf.3 \
sc_RegionTimer.3 \
sc_Timer.3 \
sc_Units.3 \
sc_Identifier.3 \
sc_Identity.3 \
sc_RefCount.3 \
sc_RefBase.3 \
sc_Ref.3 \
sc_SavableStateProxy.3 \
sc_SavableState.3 \
sc_StateOutBin.3 \
sc_StateInBin.3 \
sc_StateOutFile.3 \
sc_StateInFile.3 \
sc_StateOutText.3 \
sc_StateInText.3 \
sc_StateIn.3 \
sc_StateOut.3 \
sc_TranslateData.3 \
sc_TranslateDataByteSwap.3 \
sc_TranslateDataOut.3 \
sc_TranslateDataIn.3
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