diff options
Diffstat (limited to 'science/mpqc/files/manpages')
| -rw-r--r-- | science/mpqc/files/manpages | 462 |
1 files changed, 231 insertions, 231 deletions
diff --git a/science/mpqc/files/manpages b/science/mpqc/files/manpages index f1dd2f7e2f82..acc2ab5fd59e 100644 --- a/science/mpqc/files/manpages +++ b/science/mpqc/files/manpages @@ -1,232 +1,232 @@ MAN3= \ -sc__AccResult.3 \ -sc__AccResultInfo.3 \ -sc__ActiveMsgMemoryGrp.3 \ -sc__AngularIntegrator.3 \ -sc__AtomInfo.3 \ -sc__BFGSUpdate.3 \ -sc__BcastState.3 \ -sc__BcastStateInBin.3 \ -sc__BcastStateRecv.3 \ -sc__BcastStateSend.3 \ -sc__Becke88XFunctional.3 \ -sc__BeckeIntegrationWeight.3 \ -sc__BendSimpleCo.3 \ -sc__CLHF.3 \ -sc__CLSCF.3 \ -sc__CartMolecularCoor.3 \ -sc__CartesianIter.3 \ -sc__CharacterTable.3 \ -sc__ClassDesc.3 \ -sc__ClassKey.3 \ -sc__Compute.3 \ -sc__ConnollyShape.3 \ -sc__Convergence.3 \ -sc__CorrelationTable.3 \ -sc__DFPUpdate.3 \ -sc__DIIS.3 \ -sc__Debugger.3 \ -sc__DenFunctional.3 \ -sc__DenIntegrator.3 \ -sc__DerivCenters.3 \ -sc__DescribedClass.3 \ -sc__DiagSCMatrix.3 \ -sc__DiscreteConnollyShape.3 \ -sc__DistSCMatrixKit.3 \ -sc__DistShellPair.3 \ -sc__EFCOpt.3 \ -sc__EulerMaclaurinRadialIntegrator.3 \ -sc__ExEnv.3 \ -sc__FinDispMolecularHessian.3 \ -sc__ForceLink.3 \ -sc__ForceLinkBase.3 \ -sc__Function.3 \ -sc__G96XFunctional.3 \ -sc__GaussLegendreAngularIntegrator.3 \ -sc__GaussianBasisSet.3 \ -sc__GaussianBasisSet__ValueData.3 \ -sc__GaussianShell.3 \ -sc__HSOSHF.3 \ -sc__HSOSSCF.3 \ -sc__HessianUpdate.3 \ -sc__ISphericalTransform.3 \ -sc__Identifier.3 \ -sc__Identity.3 \ -sc__IdentityTransform.3 \ -sc__Int1eV3.3 \ -sc__Int2eV3.3 \ -sc__IntCoor.3 \ -sc__IntCoorGen.3 \ -sc__IntMolecularCoor.3 \ -sc__Integral.3 \ -sc__IntegralV3.3 \ -sc__IntegrationWeight.3 \ -sc__IrreducibleRepresentation.3 \ -sc__KeyVal.3 \ -sc__LSDACFunctional.3 \ -sc__LYPCFunctional.3 \ -sc__LebedevLaikovIntegrator.3 \ -sc__LinIPSimpleCo.3 \ -sc__LinOPSimpleCo.3 \ -sc__LineOpt.3 \ -sc__LocalSCMatrixKit.3 \ -sc__MBPT2.3 \ -sc__MPIMessageGrp.3 \ -sc__MTMPIMemoryGrp.3 \ -sc__MemoryGrp.3 \ -sc__MemoryGrpBuf.3 \ -sc__MessageGrp.3 \ -sc__MolecularCoor.3 \ -sc__MolecularEnergy.3 \ -sc__MolecularFormula.3 \ -sc__MolecularFrequencies.3 \ -sc__Molecule.3 \ -sc__MsgMemoryGrp.3 \ -sc__MsgStateBufRecv.3 \ -sc__MsgStateRecv.3 \ -sc__MsgStateSend.3 \ -sc__NCAccResult.3 \ -sc__NCResult.3 \ -sc__NElFunctional.3 \ -sc__NonlinearTransform.3 \ -sc__OneBodyDerivInt.3 \ -sc__OneBodyDerivIntV3.3 \ -sc__OneBodyInt.3 \ -sc__OneBodyIntV3.3 \ -sc__OneBodyWavefunction.3 \ -sc__Optimize.3 \ -sc__P86CFunctional.3 \ -sc__PBECFunctional.3 \ -sc__PBEXFunctional.3 \ -sc__PW86XFunctional.3 \ -sc__PW91CFunctional.3 \ -sc__PW91XFunctional.3 \ -sc__PW92LCFunctional.3 \ -sc__PZ81LCFunctional.3 \ -sc__ParentClass.3 \ -sc__ParentClasses.3 \ -sc__ParsedKeyVal.3 \ -sc__PointGroup.3 \ -sc__PointInputData.3 \ -sc__PointOutputData.3 \ -sc__PowellUpdate.3 \ -sc__ProcMemoryGrp.3 \ -sc__ProcMessageGrp.3 \ -sc__ProcThreadGrp.3 \ -sc__PsiCCSD.3 \ -sc__PsiCCSD_T.3 \ -sc__PsiCLHF.3 \ -sc__PsiExEnv.3 \ -sc__PsiFile11.3 \ -sc__PsiHSOSHF.3 \ -sc__PsiInput.3 \ -sc__PsiSCF.3 \ -sc__PsiUHF.3 \ -sc__PsiWavefunction.3 \ -sc__PthreadThreadGrp.3 \ -sc__PumaThreadGrp.3 \ -sc__QNewtonOpt.3 \ -sc__RadialAngularIntegrator.3 \ -sc__RadialIntegrator.3 \ -sc__RedundMolecularCoor.3 \ -sc__RedundantCartesianIter.3 \ -sc__RedundantCartesianSubIter.3 \ -sc__Ref.3 \ -sc__RefBase.3 \ -sc__RefCount.3 \ -sc__RefDiagSCMatrix.3 \ -sc__RefSCDimension.3 \ -sc__RefSCMatrix.3 \ -sc__RefSCVector.3 \ -sc__RefSymmSCMatrix.3 \ -sc__ReplSCMatrixKit.3 \ -sc__Result.3 \ -sc__ResultInfo.3 \ -sc__SCBlockInfo.3 \ -sc__SCDimension.3 \ -sc__SCElementOp.3 \ -sc__SCElementOp2.3 \ -sc__SCElementOp3.3 \ -sc__SCExtrapData.3 \ -sc__SCExtrapError.3 \ -sc__SCF.3 \ -sc__SCFormIO.3 \ -sc__SCMatrix.3 \ -sc__SCMatrixBlock.3 \ -sc__SCMatrixBlockIter.3 \ -sc__SCMatrixDiagBlock.3 \ -sc__SCMatrixDiagSubBlock.3 \ -sc__SCMatrixKit.3 \ -sc__SCMatrixLTriBlock.3 \ -sc__SCMatrixLTriSubBlock.3 \ -sc__SCMatrixRectBlock.3 \ -sc__SCMatrixRectSubBlock.3 \ -sc__SCMatrixSubblockIter.3 \ -sc__SCVector.3 \ -sc__SCVectorSimpleBlock.3 \ -sc__SCVectorSimpleSubBlock.3 \ -sc__SOBasis.3 \ -sc__SOTransform.3 \ -sc__SOTransformFunction.3 \ -sc__SOTransformShell.3 \ -sc__SSAccResult.3 \ -sc__SavableState.3 \ -sc__SavableStateProxy.3 \ -sc__ScaledTorsSimpleCo.3 \ -sc__SelfConsistentExtrapolation.3 \ -sc__SetIntCoor.3 \ -sc__Shape.3 \ -sc__ShellRotation.3 \ -sc__ShmMemoryGrp.3 \ -sc__ShmMessageGrp.3 \ -sc__SimpleCo.3 \ -sc__SlaterXFunctional.3 \ -sc__SphericalTransform.3 \ -sc__SphericalTransformComponent.3 \ -sc__SphericalTransformIter.3 \ -sc__StateIn.3 \ -sc__StateInBin.3 \ -sc__StateInFile.3 \ -sc__StateInText.3 \ -sc__StateOut.3 \ -sc__StateOutBin.3 \ -sc__StateOutFile.3 \ -sc__StateOutText.3 \ -sc__StateRecv.3 \ -sc__StateSend.3 \ -sc__StdDenFunctional.3 \ -sc__StreSimpleCo.3 \ -sc__SumDenFunctional.3 \ -sc__SumIntCoor.3 \ -sc__SymRep.3 \ -sc__SymmMolecularCoor.3 \ -sc__SymmSCMatrix.3 \ -sc__SymmetryOperation.3 \ -sc__Thread.3 \ -sc__ThreadGrp.3 \ -sc__ThreadLock.3 \ -sc__TorsSimpleCo.3 \ -sc__TranslateData.3 \ -sc__TranslateDataByteSwap.3 \ -sc__TranslateDataIn.3 \ -sc__TranslateDataOut.3 \ -sc__TwoBodyDerivInt.3 \ -sc__TwoBodyDerivIntV3.3 \ -sc__TwoBodyInt.3 \ -sc__TwoBodyIntV3.3 \ -sc__UnionShape.3 \ -sc__Units.3 \ -sc__UnrestrictedSCF.3 \ -sc__VDWShape.3 \ -sc__VWN1LCFunctional.3 \ -sc__VWN2LCFunctional.3 \ -sc__VWN3LCFunctional.3 \ -sc__VWN4LCFunctional.3 \ -sc__VWN5LCFunctional.3 \ -sc__VWNLCFunctional.3 \ -sc__Volume.3 \ -sc__Wavefunction.3 \ -sc__XalphaFunctional.3 \ -sc__intMessageGrp.3 \ -sc__mPW91XFunctional.3 \ -sc__scprintf.3 +sc_AccResult.3 \ +sc_AccResultInfo.3 \ +sc_ActiveMsgMemoryGrp.3 \ +sc_AngularIntegrator.3 \ +sc_AtomInfo.3 \ +sc_BFGSUpdate.3 \ +sc_BcastState.3 \ +sc_BcastStateInBin.3 \ +sc_BcastStateRecv.3 \ +sc_BcastStateSend.3 \ +sc_Becke88XFunctional.3 \ +sc_BeckeIntegrationWeight.3 \ +sc_BendSimpleCo.3 \ +sc_CLHF.3 \ +sc_CLSCF.3 \ +sc_CartMolecularCoor.3 \ +sc_CartesianIter.3 \ +sc_CharacterTable.3 \ +sc_ClassDesc.3 \ +sc_ClassKey.3 \ +sc_Compute.3 \ +sc_ConnollyShape.3 \ +sc_Convergence.3 \ +sc_CorrelationTable.3 \ +sc_DFPUpdate.3 \ +sc_DIIS.3 \ +sc_Debugger.3 \ +sc_DenFunctional.3 \ +sc_DenIntegrator.3 \ +sc_DerivCenters.3 \ +sc_DescribedClass.3 \ +sc_DiagSCMatrix.3 \ +sc_DiscreteConnollyShape.3 \ +sc_DistSCMatrixKit.3 \ +sc_DistShellPair.3 \ +sc_EFCOpt.3 \ +sc_EulerMaclaurinRadialIntegrator.3 \ +sc_ExEnv.3 \ +sc_FinDispMolecularHessian.3 \ +sc_ForceLink.3 \ +sc_ForceLinkBase.3 \ +sc_Function.3 \ +sc_G96XFunctional.3 \ +sc_GaussLegendreAngularIntegrator.3 \ +sc_GaussianBasisSet.3 \ +sc_GaussianBasisSet_ValueData.3 \ +sc_GaussianShell.3 \ +sc_HSOSHF.3 \ +sc_HSOSSCF.3 \ +sc_HessianUpdate.3 \ +sc_ISphericalTransform.3 \ +sc_Identifier.3 \ +sc_Identity.3 \ +sc_IdentityTransform.3 \ +sc_Int1eV3.3 \ +sc_Int2eV3.3 \ +sc_IntCoor.3 \ +sc_IntCoorGen.3 \ +sc_IntMolecularCoor.3 \ +sc_Integral.3 \ +sc_IntegralV3.3 \ +sc_IntegrationWeight.3 \ +sc_IrreducibleRepresentation.3 \ +sc_KeyVal.3 \ +sc_LSDACFunctional.3 \ +sc_LYPCFunctional.3 \ +sc_LebedevLaikovIntegrator.3 \ +sc_LinIPSimpleCo.3 \ +sc_LinOPSimpleCo.3 \ +sc_LineOpt.3 \ +sc_LocalSCMatrixKit.3 \ +sc_MBPT2.3 \ +sc_MPIMessageGrp.3 \ +sc_MTMPIMemoryGrp.3 \ +sc_MemoryGrp.3 \ +sc_MemoryGrpBuf.3 \ +sc_MessageGrp.3 \ +sc_MolecularCoor.3 \ +sc_MolecularEnergy.3 \ +sc_MolecularFormula.3 \ +sc_MolecularFrequencies.3 \ +sc_Molecule.3 \ +sc_MsgMemoryGrp.3 \ +sc_MsgStateBufRecv.3 \ +sc_MsgStateRecv.3 \ +sc_MsgStateSend.3 \ +sc_NCAccResult.3 \ +sc_NCResult.3 \ +sc_NElFunctional.3 \ +sc_NonlinearTransform.3 \ +sc_OneBodyDerivInt.3 \ +sc_OneBodyDerivIntV3.3 \ +sc_OneBodyInt.3 \ +sc_OneBodyIntV3.3 \ +sc_OneBodyWavefunction.3 \ +sc_Optimize.3 \ +sc_P86CFunctional.3 \ +sc_PBECFunctional.3 \ +sc_PBEXFunctional.3 \ +sc_PW86XFunctional.3 \ +sc_PW91CFunctional.3 \ +sc_PW91XFunctional.3 \ +sc_PW92LCFunctional.3 \ +sc_PZ81LCFunctional.3 \ +sc_ParentClass.3 \ +sc_ParentClasses.3 \ +sc_ParsedKeyVal.3 \ +sc_PointGroup.3 \ +sc_PointInputData.3 \ +sc_PointOutputData.3 \ +sc_PowellUpdate.3 \ +sc_ProcMemoryGrp.3 \ +sc_ProcMessageGrp.3 \ +sc_ProcThreadGrp.3 \ +sc_PsiCCSD.3 \ +sc_PsiCCSD_T.3 \ +sc_PsiCLHF.3 \ +sc_PsiExEnv.3 \ +sc_PsiFile11.3 \ +sc_PsiHSOSHF.3 \ +sc_PsiInput.3 \ +sc_PsiSCF.3 \ +sc_PsiUHF.3 \ +sc_PsiWavefunction.3 \ +sc_PthreadThreadGrp.3 \ +sc_PumaThreadGrp.3 \ +sc_QNewtonOpt.3 \ +sc_RadialAngularIntegrator.3 \ +sc_RadialIntegrator.3 \ +sc_RedundMolecularCoor.3 \ +sc_RedundantCartesianIter.3 \ +sc_RedundantCartesianSubIter.3 \ +sc_Ref.3 \ +sc_RefBase.3 \ +sc_RefCount.3 \ +sc_RefDiagSCMatrix.3 \ +sc_RefSCDimension.3 \ +sc_RefSCMatrix.3 \ +sc_RefSCVector.3 \ +sc_RefSymmSCMatrix.3 \ +sc_ReplSCMatrixKit.3 \ +sc_Result.3 \ +sc_ResultInfo.3 \ +sc_SCBlockInfo.3 \ +sc_SCDimension.3 \ +sc_SCElementOp.3 \ +sc_SCElementOp2.3 \ +sc_SCElementOp3.3 \ +sc_SCExtrapData.3 \ +sc_SCExtrapError.3 \ +sc_SCF.3 \ +sc_SCFormIO.3 \ +sc_SCMatrix.3 \ +sc_SCMatrixBlock.3 \ +sc_SCMatrixBlockIter.3 \ +sc_SCMatrixDiagBlock.3 \ +sc_SCMatrixDiagSubBlock.3 \ +sc_SCMatrixKit.3 \ +sc_SCMatrixLTriBlock.3 \ +sc_SCMatrixLTriSubBlock.3 \ +sc_SCMatrixRectBlock.3 \ +sc_SCMatrixRectSubBlock.3 \ +sc_SCMatrixSubblockIter.3 \ +sc_SCVector.3 \ +sc_SCVectorSimpleBlock.3 \ +sc_SCVectorSimpleSubBlock.3 \ +sc_SOBasis.3 \ +sc_SOTransform.3 \ +sc_SOTransformFunction.3 \ +sc_SOTransformShell.3 \ +sc_SSAccResult.3 \ +sc_SavableState.3 \ +sc_SavableStateProxy.3 \ +sc_ScaledTorsSimpleCo.3 \ +sc_SelfConsistentExtrapolation.3 \ +sc_SetIntCoor.3 \ +sc_Shape.3 \ +sc_ShellRotation.3 \ +sc_ShmMemoryGrp.3 \ +sc_ShmMessageGrp.3 \ +sc_SimpleCo.3 \ +sc_SlaterXFunctional.3 \ +sc_SphericalTransform.3 \ +sc_SphericalTransformComponent.3 \ +sc_SphericalTransformIter.3 \ +sc_StateIn.3 \ +sc_StateInBin.3 \ +sc_StateInFile.3 \ +sc_StateInText.3 \ +sc_StateOut.3 \ +sc_StateOutBin.3 \ +sc_StateOutFile.3 \ +sc_StateOutText.3 \ +sc_StateRecv.3 \ +sc_StateSend.3 \ +sc_StdDenFunctional.3 \ +sc_StreSimpleCo.3 \ +sc_SumDenFunctional.3 \ +sc_SumIntCoor.3 \ +sc_SymRep.3 \ +sc_SymmMolecularCoor.3 \ +sc_SymmSCMatrix.3 \ +sc_SymmetryOperation.3 \ +sc_Thread.3 \ +sc_ThreadGrp.3 \ +sc_ThreadLock.3 \ +sc_TorsSimpleCo.3 \ +sc_TranslateData.3 \ +sc_TranslateDataByteSwap.3 \ +sc_TranslateDataIn.3 \ +sc_TranslateDataOut.3 \ +sc_TwoBodyDerivInt.3 \ +sc_TwoBodyDerivIntV3.3 \ +sc_TwoBodyInt.3 \ +sc_TwoBodyIntV3.3 \ +sc_UnionShape.3 \ +sc_Units.3 \ +sc_UnrestrictedSCF.3 \ +sc_VDWShape.3 \ +sc_VWN1LCFunctional.3 \ +sc_VWN2LCFunctional.3 \ +sc_VWN3LCFunctional.3 \ +sc_VWN4LCFunctional.3 \ +sc_VWN5LCFunctional.3 \ +sc_VWNLCFunctional.3 \ +sc_Volume.3 \ +sc_Wavefunction.3 \ +sc_XalphaFunctional.3 \ +sc_intMessageGrp.3 \ +sc_mPW91XFunctional.3 \ +sc_scprintf.3 |