- g -

• g_function() : QMCPsiPotential
• gamma_cf() : MathFunctions
• gamma_inc() : MathFunctions
• gamma_log() : MathFunctions
• gamma_series() : MathFunctions
• gasdev() : Random
• gatherDensities() : QMCManager
• gatherExtraProperties() : QMCManager
• gatherForces() : QMCManager
• gatherHistograms() : QMCManager
• gatherProperties() : QMCManager
• gaussianParamDepMatrix() : QMCThreeBodyCorrelationFunctionParameters
• gemm() : Array2D< T >
• generalizedEigenvectors() : Array2D< T >
• generateCube() : QMCNuclearForces
• generateInitialGuessFittingParameters() : QMCProperty
• generateNewPopulation() : CKGeneticAlgorithm1
• generatePhiCoordinate() : QMCDansWalkerInitialization
• generateRadialDistances() : QMCDansWalkerInitialization
• generateThetaCoordinate() : QMCDansWalkerInitialization
• get() : Array1D< T > , Array2D< T > , SortedParameterScorePairList
• get_a_diag() : QMCEigenSearch
• get_p2_xa() : QMCCorrelationFunction , QMCSlater , QMCThreeBodyCorrelationFunction , Umrigar2CorrelationFunction , Williamson2CorrelationFunction , Yukawa2CorrelationFunction , ZeroCorrelationFunction , ZeroThreeBodyCorrelationFunction , Anderson2CorrelationFunction , Cambridge2CorrelationFunction , CambridgeThreeBodyCorrelationFunction , FixedCuspPadeCorrelationFunction , JuliusCorrelationFunction , PadeCorrelationFunction , Polynomial
• get_p2_xa_ln() : QMCJastrow , QMCJastrowElectronElectron , QMCJastrowElectronNuclear , QMCThreeBodyJastrow
• get_p3_xxa() : Anderson2CorrelationFunction , Cambridge2CorrelationFunction , CambridgeThreeBodyCorrelationFunction , FixedCuspPadeCorrelationFunction , JuliusCorrelationFunction , PadeCorrelationFunction , Polynomial , QMCCorrelationFunction , QMCSlater , QMCThreeBodyCorrelationFunction , Umrigar2CorrelationFunction , Williamson2CorrelationFunction , Yukawa2CorrelationFunction , ZeroCorrelationFunction , ZeroThreeBodyCorrelationFunction
• get_p3_xxa_ln() : QMCJastrow , QMCJastrowElectronElectron , QMCJastrowElectronNuclear , QMCThreeBodyJastrow
• get_p_a() : Cambridge2CorrelationFunction , CambridgeThreeBodyCorrelationFunction , FixedCuspPadeCorrelationFunction , JuliusCorrelationFunction , PadeCorrelationFunction , Polynomial , QMCCorrelationFunction , QMCJastrow , QMCSlater , QMCThreeBodyCorrelationFunction , Umrigar2CorrelationFunction , Williamson2CorrelationFunction , Yukawa2CorrelationFunction , ZeroCorrelationFunction , ZeroThreeBodyCorrelationFunction , Anderson2CorrelationFunction
• get_p_a_ln() : QMCJastrow , QMCJastrowElectronElectron , QMCJastrowElectronNuclear , QMCThreeBodyJastrow
• get_rc() : QMCElectronNucleusCuspParameters
• get_xyz() : AtomicOrbitalInverter
• getAcceptanceProbability() : QMCWalker
• getAge() : QMCWalker
• getAIParameters() : QMCInput
• getAlphaHistograms() : QMCRun
• getAverage() : QMCProperty , QMCStatistic
• getBetaHistograms() : QMCRun
• getBFCoeffs() : QMCBasisFunction
• getBlockKurtosis() : QMCProperty
• getBlockSkewness() : QMCProperty
• getBlockStandardDeviation() : QMCProperty
• getBlockStandardDeviationStandardDeviation() : QMCProperty
• getBlockVariance() : QMCProperty
• getBlockVarianceStandardDeviation() : QMCProperty
• getBooleanAttribute() : XMLElement
• getChiDensity() : QMCSlater
• getChildren() : XMLElement
• getCINorm() : QMCWavefunction
• getCIParameters() : QMCWavefunction
• getCoeff() : QMCWavefunction
• getCoefficient() : Polynomial , PowerSeries
• getCoefficients() : Polynomial , PowerSeries
• getCommandPollingStopwatch() : QMCStopwatches
• getCommunicationSynchronizationStopwatch() : QMCStopwatches
• getContent() : XMLElement
• getCorrelatedSamples() : QMCDerivativeProperties
• getCorrelationFunction() : QMCCorrelationFunctionParameters
• getCorrelationLength() : QMCProperty
• getCutoffDist() : CambridgeThreeBodyCorrelationFunction , QMCThreeBodyCorrelationFunction , QMCThreeBodyCorrelationFunctionParameters , ZeroThreeBodyCorrelationFunction
• getDataForCI() : QMCWavefunction
• getDecorrDepth() : QMCProperty
• getDecorrObjectIndex() : QMCEquilibrationArray
• getDenominatorCoeffs() : ZeroCorrelationFunction , Cambridge2CorrelationFunction , FixedCuspPadeCorrelationFunction , JuliusCorrelationFunction , PadeCorrelationFunction , QMCCorrelationFunction
• getDensities() : QMCNuclearForces
• getDerivativeScore() : QMCObjectiveFunctionResult
• getDeterminantSwaps() : QMCWavefunction
• getDoubleAttribute() : XMLElement
• getdr() : QMCRun
• getEffectiveTimeStep() : QMCDerivativeProperties
• getEffectiveTimeStepStandardDeviation() : QMCDerivativeProperties
• getEffectiveTimeStepVariance() : QMCDerivativeProperties
• getElectron1Gradient() : CambridgeThreeBodyCorrelationFunction , QMCThreeBodyCorrelationFunction , ZeroThreeBodyCorrelationFunction
• getElectron2Gradient() : CambridgeThreeBodyCorrelationFunction , QMCThreeBodyCorrelationFunction , ZeroThreeBodyCorrelationFunction
• getElectronDownElectronDownNuclearParameters() : QMCJastrowParameters
• getElectronDownElectronDownParameters() : QMCJastrowParameters
• getElectronDownNuclearParameters() : QMCJastrowParameters
• getElectronUpElectronDownNuclearParameters() : QMCJastrowParameters
• getElectronUpElectronDownParameters() : QMCJastrowParameters
• getElectronUpElectronUpNuclearParameters() : QMCJastrowParameters
• getElectronUpElectronUpParameters() : QMCJastrowParameters
• getElectronUpNuclearParameters() : QMCJastrowParameters
• getEnergy() : QMCPotential_Energy
• getEnergyAve() : QMCObjectiveFunctionResult
• getEnergyEE() : QMCPotential_Energy , QMCSCFJastrow
• getEnergyNE() : QMCPotential_Energy , QMCSCFJastrow
• getEnergyVar() : QMCObjectiveFunctionResult
• getEquilibrationStopwatch() : QMCEquilibrationArray , QMCExtendedProperties , QMCRun , QMCStopwatches
• getFilename() : QMCConfigIO
• getFirstDerivativeValue() : Cambridge2CorrelationFunction , CubicSpline , FixedCuspPadeCorrelationFunction , FunctionR1toR1 , JuliusCorrelationFunction , LinearSpline , PadeCorrelationFunction , Polynomial , QMCCorrelationFunction , ZeroCorrelationFunction
• getFree() : QMCThreeBodyCorrelationFunctionParameters
• getFreeParameters() : QMCThreeBodyCorrelationFunctionParameters
• getFunctionValue() : Cambridge2CorrelationFunction , CambridgeThreeBodyCorrelationFunction , CubicSpline , FixedCuspPadeCorrelationFunction , FunctionR1toR1 , JuliusCorrelationFunction , LinearSpline , PadeCorrelationFunction , Polynomial , QMCCorrelationFunction , QMCThreeBodyCorrelationFunction , ZeroCorrelationFunction , ZeroThreeBodyCorrelationFunction
• getFWProperties() : QMCRun
• getFWTimeStepProperties() : QMCRun
• getGatherPropertiesStopwatch() : QMCStopwatches
• getGradientLnJastrow() : QMCJastrow
• getGradPsiRatio() : QMCSlater
• getGrid() : QMCMolecule
• getInitializationStopwatch() : QMCStopwatches
• getInputData() : QMCManager
• getIntAttribute() : XMLElement
• getJastrow() : QMCJastrow
• getJWParameters() : QMCJastrowParameters
• getKineticEnergy() : QMCSCFJastrow
• getKurtosis() : QMCProperty , QMCStatistic
• getLaplacianLnJastrow() : QMCJastrow
• getLaplacianPsiRatio() : QMCSlater
• getLaplacianValue() : ZeroThreeBodyCorrelationFunction , CambridgeThreeBodyCorrelationFunction , QMCThreeBodyCorrelationFunction
• getLapPoly() : CambridgeThreeBodyCorrelationFunction
• getLineNr() : XMLElement , XMLParseException
• getLnJastrow() : QMCJastrow
• getLocalEnergy() : QMCSCFJastrow
• getLocalEnergyEstimator() : QMCWalker
• getLogWeightsAve() : QMCObjectiveFunctionResult
• getLogWeightsVar() : QMCObjectiveFunctionResult
• getLongString() : QMCProperty
• getMessage() : Exception
• getModifiedLocalEnergy() : QMCWalkerData
• getName() : XMLElement
• getNuclearCharge() : QMCMolecule
• getNucleiTypes() : QMCJastrowParameters
• getNumberActiveOrbitals() : QMCWavefunction
• getNumberAIParameters() : QMCInput
• getNumberAtoms() : QMCMolecule
• getNumberBasisFunctions() : QMCBasisFunctionCoefficients , QMCBasisFunction , QMCWavefunction
• getNumberCIParameters() : QMCWavefunction
• getNumberCoefficients() : Polynomial , PowerSeries
• getNumberConfigsWritten() : QMCConfigIO
• getNumberDeterminants() : QMCWavefunction
• getNumberEdnEdnParameters() : QMCJastrowParameters
• getNumberEEParameters() : QMCJastrowParameters
• getNumberElectrons() : QMCSlater , QMCWavefunction
• getNumberEupEdnParameters() : QMCJastrowParameters
• getNumberEupEupParameters() : QMCJastrowParameters
• getNumberJWParameters() : QMCJastrowParameters
• getNumberNEdnEdnParameters() : QMCJastrowParameters
• getNumberNEParameters() : QMCJastrowParameters
• getNumberNEupEdnParameters() : QMCJastrowParameters
• getNumberNEupEupParameters() : QMCJastrowParameters
• getNumberNEupParameters() : QMCJastrowParameters
• getNumberOfFreeParameters() : QMCThreeBodyCorrelationFunctionParameters
• getNumberOfTotalParameters() : QMCThreeBodyCorrelationFunctionParameters
• getNumberOfWalkers() : QMCRun
• getNumberOrbitals() : QMCWavefunction
• getNumberORParameters() : QMCWavefunction
• getNumberSamples() : QMCObjectiveFunctionResult , QMCStatistic , QMCProperty
• getNumBins() : QMCNuclearForces
• getNumeratorCoeffs() : JuliusCorrelationFunction , FixedCuspPadeCorrelationFunction , ZeroCorrelationFunction , Cambridge2CorrelationFunction , PadeCorrelationFunction , QMCCorrelationFunction
• getNumGPUWalkers() : QMCFlags
• getObjectiveFunction() : QMCEigenSearch , QMCLineSearch
• getOccupations() : QMCWavefunction
• getOppSpinHistogram() : QMCRun
• getOppxCorrelationDiagram() : QMCRun
• getOppyCorrelationDiagram() : QMCRun
• getOppzCorrelationDiagram() : QMCRun
• getOptimizationStopwatch() : QMCStopwatches
• getOrigGradient() : QMCElectronNucleusCusp
• getOrigLocalEnergy() : QMCElectronNucleusCusp
• getORParameters() : QMCWavefunction
• getParameterGradient() : QMCDerivativeProperties
• getParameterHamiltonian() : QMCDerivativeProperties
• getParameterHessian() : QMCDerivativeProperties
• getParameterOverlap() : QMCDerivativeProperties
• getParameters() : ParameterScorePair , QMCCorrelationFunctionParameters , QMCEigenSearch
• getParameterValue() : QMCDerivativeProperties
• getParticle1Type() : QMCCorrelationFunctionParameters , QMCThreeBodyCorrelationFunctionParameters
• getParticle2Type() : QMCCorrelationFunctionParameters , QMCThreeBodyCorrelationFunctionParameters
• getParticle3Type() : QMCThreeBodyCorrelationFunctionParameters
• getPhiArray() : AngleDistributions
• getPllSpinHistogram() : QMCRun
• getPllxCorrelationDiagram() : QMCRun
• getPllyCorrelationDiagram() : QMCRun
• getPllzCorrelationDiagram() : QMCRun
• getPoles() : JuliusCorrelationFunction , QMCJastrowParameters , ZeroCorrelationFunction , QMCCorrelationFunctionParameters , FixedCuspPadeCorrelationFunction , PadeCorrelationFunction , QMCCorrelationFunction , Cambridge2CorrelationFunction
• getPopulationSizeBiasCorrectionFactor() : QMCRun
• GetPoten() : QMCPsiPotential
• getPotentialEnergy() : QMCSCFJastrow
• getPropagationStopwatch() : QMCStopwatches , QMCExtendedProperties , QMCEquilibrationArray , QMCRun
• getProperties() : QMCExtendedProperties , QMCRun
• getPsi() : QMCSCFJastrow , QMCSlater
• getR() : QMCWalker
• getRadialArray() : RadialDistributions
• getResultsOutputStream() : QMCManager
• getRoots() : Polynomial
• getSampleVariance() : QMCDerivativeProperties
• getScore() : QMCObjectiveFunctionResult , ParameterScorePair
• getSecondDerivativeValue() : ZeroCorrelationFunction , LinearSpline , Polynomial , PadeCorrelationFunction , CubicSpline , FunctionR1toR1 , FixedCuspPadeCorrelationFunction , QMCCorrelationFunction , JuliusCorrelationFunction , Cambridge2CorrelationFunction
• getSendCommandStopwatch() : QMCStopwatches
• getSeriallyCorrelatedStandardDeviation() : QMCProperty
• getSeriallyCorrelatedVariance() : QMCProperty
• getShortString() : QMCProperty
• getSigmaSq() : QMCElectronNucleusCuspParameters
• getSkewness() : QMCProperty , QMCStatistic
• getStandardDeviation() : QMCProperty , QMCStatistic
• getStandardDeviationStandardDeviation() : QMCProperty
• getStartingStep() : QMCExtendedProperties
• getStringAttribute() : XMLElement
• getTemperTerm() : QMCNuclearForces
• getThetaArray() : AngleDistributions
• getThirdDerivativeValue() : Polynomial
• getThreeBodyCorrelationFunction() : QMCThreeBodyCorrelationFunctionParameters
• getTimeStepProperties() : QMCRun
• getTotalNumberOfParameters() : QMCCorrelationFunctionParameters
• getTotalTimeStopwatch() : QMCStopwatches
• getTrailWeight() : QMCWalker
• getUnusedIndicator() : QMCWavefunction
• getValue() : QMCDouble
• getVariance() : QMCStatistic , QMCProperty
• GetVEff() : QMCHartreeFock
• getVirialRatio() : QMCDerivativeProperties
• getVirialRatioStandardDeviation() : QMCDerivativeProperties
• getVirialRatioVariance() : QMCDerivativeProperties
• getWalkerData() : QMCWalker
• getWeight() : QMCWalker
• getWeights() : QMCRun
• grad() : QMCObjectiveFunction
• GradObjectiveFunctionForWalkers() : QMCMikesBetterWalkerInitialization