Here is a list of all functions with links to the classes they belong to:

- p -

• p() : madness::SpectralPropagator, madness::SpectralPropagatorGaussLobatto
• P2Op() : madness::WorldContainerImpl< keyT, valueT, hashfunT >::P2Op
• p_orbital() : madness::Znemo::p_orbital
• PairEnergies() : madness::PairEnergies
• pairs2vector() : madness::Pairs< T >
• PairVectorMap() : madness::PairVectorMap
• par_reduce() : madness::ProfileStat< T >, madness::WorldProfileEntry
• ParallelInputArchive() : madness::archive::ParallelInputArchive< localarchiveT >
• ParallelOutputArchive() : madness::archive::ParallelOutputArchive< localarchiveT >
• parameter_exists() : madness::QCCalculationParametersBase
• Parameters() : madness::CCConvolutionOperator< T, NDIM >::Parameters, madness::MP2::Parameters, Parameters
• ParametrizedExchange() : madness::ParametrizedExchange
• parent() : Key, madness::Key< NDIM >
• parent_to_child() : madness::FunctionImpl< T, NDIM >
• parent_to_child_NS() : madness::FunctionImpl< T, NDIM >
• ParserHandler() : ParserHandler< T, NDIM >
• partial_inner() : madness::CCPairFunction< T, NDIM >, madness::FunctionImpl< T, NDIM >
• partial_inner_contract() : madness::FunctionImpl< T, NDIM >
• partial_upsample() : madness::SeparatedConvolution< Q, NDIM >
• partial_wave() : madness::PNOParameters
• particle() : madness::particle< PDIM >, madness::SeparatedConvolution< Q, NDIM >
• particle1() : madness::CompositeFactory< T, NDIM, MDIM >, madness::particle< PDIM >
• particle2() : madness::CompositeFactory< T, NDIM, MDIM >, madness::particle< PDIM >
• partition() : madness::LBNodeDeux< NDIM >
• partition_tasks() : madness::MacroTaskPartitioner
• Partitioner() : madness::MP3::MacroTaskMP3::Partitioner
• PartitionPmap() : PartitionPmap
• pause() : madness::WorldProfileObj
• Pbar_omega() : Pbar_omega
• PCM() : madness::PCM
• pcm_data() : madness::CalculationParameters
• Peasant() : Peasant
• penalty() : Fred
• pending() : madness::WorldObject< Derived >
• pending_mutex() : madness::WorldObject< Derived >
• PendingMsg() : madness::detail::PendingMsg
• Perform() : CFFT
• permutation() : madness::permutation
• perturbed_molecular_pot() : SurfaceMoleculeInteraction
• pg_operator() : madness::pg_operator
• phase() : madness::Convolution1D< Q >
• phi0_on_demand() : madness::MP2
• phi_for_mul() : madness::FunctionImpl< T, NDIM >
• phis() : madness::DFT< T, NDIM >, madness::EigSolver< T, NDIM >, madness::HartreeFock< T, NDIM >
• physical_B() : madness::Nemo_complex_Parameters
• ping() : Foo
• ping_am() : Foo
• pit() : madness::F12Potentials, madness::PNO
• plane() : madness::PlotParameters
• PlaneWaveFunctor() : madness::guessfactory::PlaneWaveFunctor
• plot() : madness::BandlimitedPropagator, madness::CC2, madness::CC_vecfunction, madness::CCFunction< T, NDIM >, madness::CCParameters, madness::Gnuplot, madness::ResponseParameters, madness::TDHF, madness::TDHF::TDHFParameters, madness::XCfunctional, Plotter, Spinor
• plot_all_orbitals() : madness::ResponseParameters
• plot_cell() : madness::CalculationParameters
• plot_cube_kernel() : madness::FunctionImpl< T, NDIM >
• plot_initial() : madness::ResponseParameters
• plot_l() : madness::ResponseParameters
• plot_p() : Calculation
• plot_pts() : madness::ResponseParameters
• plot_z() : Calculation
• plotCoords() : plotCoords
• PlotParameters() : madness::PlotParameters
• Plotter() : Plotter
• pmap() : madness::FunctionFactory< T, NDIM >
• PNO() : madness::PNO
• pno_compress() : madness::PNO
• PNOPairs() : madness::PNOPairs
• PNOParameters() : madness::PNOParameters
• pointer2WorldObject() : madness::MacroTask< taskT >::MacroTaskInternal
• pointgroup() : madness::CalculationParameters
• PointGroup() : PointGroup
• points() : GridBuilder::dummygrid
• pointwise_multiplier() : madness::FunctionImpl< T, NDIM >::pointwise_multiplier< LDIM >
• poly4erfc() : madness::poly4erfc
• polyIndex() : slymer::PolynomialCoeffs
• polyn() : madness::XCfunctional
• Polynomial() : madness::Polynomial< N >
• PolynomialCoeffs() : slymer::PolynomialCoeffs
• PolynomialFunctor() : madness::guessfactory::PolynomialFunctor, madness::guessfactory::PolynomialTrigonometricsFunctor
• pong() : Foo
• pong_am() : Foo
• pool_thread_main() : madness::ThreadPool
• PoolTaskInterface() : madness::PoolTaskInterface
• pop() : DF, madness::Stack< T, N >
• pop_back() : madness::response_space, madness::X_space
• pop_front() : madness::DQueue< T >
• pop_front_and_return() : madness::Recordlist< keyT >
• position_stream_in_library() : madness::Molecule
• post_pending_huge_msg() : madness::RMI::RmiTask
• post_process_mos() : madness::MolecularOrbitals< T, NDIM >
• post_recv_buf() : madness::RMI::RmiTask
• post_screening() : madness::Leaf_op< T, NDIM, opT, specialboxT >, madness::Leaf_op_other< T, NDIM >
• postamble_load() : madness::archive::ArchivePrePostImpl< Archive, T >, madness::archive::ArchivePrePostImpl< BufferInputArchive, T >, madness::archive::ArchivePrePostImpl< ContainerRecordInputArchive, T >, madness::archive::ArchivePrePostImpl< MPIInputArchive, T >, madness::archive::ArchivePrePostImpl< MPIRawInputArchive, T >, madness::archive::ArchivePrePostImpl< ParallelInputArchive< localarchiveT >, T >, madness::archive::ArchivePrePostImpl< TextFstreamInputArchive, T >, madness::archive::ArchivePrePostImpl< VectorInputArchive, T >
• postamble_store() : madness::archive::ArchivePrePostImpl< Archive, T >, madness::archive::ArchivePrePostImpl< BufferOutputArchive, T >, madness::archive::ArchivePrePostImpl< ContainerRecordOutputArchive, T >, madness::archive::ArchivePrePostImpl< MPIOutputArchive, T >, madness::archive::ArchivePrePostImpl< MPIRawOutputArchive, T >, madness::archive::ArchivePrePostImpl< ParallelOutputArchive< localarchiveT >, T >, madness::archive::ArchivePrePostImpl< TextFstreamOutputArchive, T >, madness::archive::ArchivePrePostImpl< VectorOutputArchive, T >
• potential() : madness::CorePotentialManager, madness::Coulomb< T, NDIM >, madness::lr_pot_functor< NDIM >
• potential_derivative() : madness::CorePotentialManager
• potential_exists() : madness::CCIntermediatePotentials
• potential_radius() : madness::Nemo_complex_Parameters
• PotentialBasisFunctor() : PotentialBasisFunctor
• PotentialManager() : madness::PotentialManager
• potentials() : madness::Znemo::potentials
• pow() : madness::detail::helper< T, N >, madness::detail::helper< T, 0 >, madness::detail::helper< T, 1 >, slymer::PolynomialCoeffs
• pre_screening() : madness::Leaf_op< T, NDIM, opT, specialboxT >, madness::Leaf_op_other< T, NDIM >
• preamble_load() : madness::archive::ArchivePrePostImpl< Archive, T >, madness::archive::ArchivePrePostImpl< BufferInputArchive, T >, madness::archive::ArchivePrePostImpl< ContainerRecordInputArchive, T >, madness::archive::ArchivePrePostImpl< MPIInputArchive, T >, madness::archive::ArchivePrePostImpl< MPIRawInputArchive, T >, madness::archive::ArchivePrePostImpl< ParallelInputArchive< localarchiveT >, T >, madness::archive::ArchivePrePostImpl< TextFstreamInputArchive, T >, madness::archive::ArchivePrePostImpl< VectorInputArchive, T >
• preamble_store() : madness::archive::ArchivePrePostImpl< Archive, T >, madness::archive::ArchivePrePostImpl< BufferOutputArchive, T >, madness::archive::ArchivePrePostImpl< ContainerRecordOutputArchive, T >, madness::archive::ArchivePrePostImpl< MPIOutputArchive, T >, madness::archive::ArchivePrePostImpl< MPIRawOutputArchive, T >, madness::archive::ArchivePrePostImpl< ParallelOutputArchive< localarchiveT >, T >, madness::archive::ArchivePrePostImpl< TextFstreamOutputArchive, T >, madness::archive::ArchivePrePostImpl< VectorOutputArchive, T >
• predefined_guess() : madness::BasisFunctions, madness::PNOParameters
• prefix() : madness::CalculationParameters
• prep_xc_args() : madness::XCOperator< T, NDIM >
• prep_xc_args_response() : madness::XCOperator< T, NDIM >
• prepare_calculation() : madness::TDHF
• prepare_not_so_simple_map() : madness::MyPmap< D >
• prepare_op() : madness::DFTCoulombOp< T, NDIM >, madness::DFTCoulombPeriodicOp< T, NDIM >, madness::DFTNuclearChargeDensityOp< T, NDIM >, madness::EigSolverOp< T, NDIM >, NuclearChargeDensityOp< T, NDIM >
• prepare_ops() : madness::EigSolver< T, NDIM >
• prepare_output_records() : madness::MacroTask< taskT >
• pretty_print() : madness::MolecularOrbitals< T, NDIM >
• PrimitiveGaussian() : slymer::PrimitiveGaussian
• print() : AtomicBasisSet, ExactSpinor, linked_list, madness::ACParameters< NDIM >, madness::AtomicBasisSet, madness::CCSize, madness::CCTimer, madness::FunctionDefaults< NDIM >, madness::LBDeuxPmap< NDIM >, madness::Molecule, madness::MyPmap< D >, madness::MyTimer, madness::PairVectorMap, madness::QCCalculationParametersBase, madness::timer, madness::Timer, madness::WorldDCPmapInterface< keyT >, madness::WorldMemInfo, madness::WorldProfile, MatrixOperator, Metric, MolecularEntity
• print_accuracy() : madness::GFit< T, NDIM >
• print_all() : AtomicBasisSet, madness::AtomicBasisSet
• print_anal() : AtomicBasisSet, madness::AtomicBasisSet
• print_and_clear_log() : madness::test_output
• print_character_table() : madness::projector_irrep
• print_contracted_basis() : madness::BasisFunctions
• print_convergence() : madness::printleveler
• print_cubefiles() : madness::MolecularOrbitals< T, NDIM >
• print_data() : madness::scf_data
• print_data_sizes() : madness::WorldDCPmapInterface< keyT >
• print_debug() : madness::printleveler
• print_demangled() : madness::profiling::TaskEvent
• print_details() : FermiNucDistFunctor
• print_energies() : madness::printleveler
• print_energy() : madness::ElectronPair
• print_events() : madness::profiling::TaskEventList, madness::profiling::TaskEventListBase
• print_f12_energies() : madness::F12Potentials
• print_fock_matrix_eigs() : madness::Solver< T, NDIM >
• print_frozen_orbitals() : madness::MolecularOrbitals< T, NDIM >, madness::TDHF
• print_grid() : madness::FunctionImpl< T, NDIM >
• print_info() : Calculation, CalculationParameters, madness::Diamagnetic_potential_factor, madness::Function< T, NDIM >, madness::FunctionImpl< T, NDIM >, madness::Localizer, madness::projector_irrep
• print_intermediate() : madness::CCConvolutionOperator< T, NDIM >
• print_json() : madness::FunctionNode< T, NDIM >
• print_level() : madness::CalculationParameters, madness::ResponseParameters, madness::TDHF::TDHFParameters
• print_line() : madness::QCParameter
• print_map() : madness::commandlineparser
• print_matrix_elements() : madness::DFT< T, NDIM >, madness::EigSolver< T, NDIM >
• print_me() : AtomicBasisFunction, madness::AtomicBasisFunction, madness::MacroTask< taskT >::MacroTaskInternal, madness::MacroTaskBase
• print_me_as_table() : madness::MacroTask< taskT >::MacroTaskInternal, madness::MacroTaskBase
• print_memory_map() : madness::MemoryMeasurer
• print_molecule() : DF
• print_norms() : Spinor
• print_options() : madness::MP2
• print_orbens() : madness::OEP
• print_pair_energies() : madness::F12Potentials
• print_parameters() : DF, madness::CC2, madness::Molecule, madness::MP2, madness::Nemo, madness::OEP, madness::PNO, madness::SCF, madness::TDHF, madness::Zcis, madness::Znemo
• print_params() : GroundStateCalculation, madness::DFParameters, madness::InitParameters
• print_plane() : madness::FunctionImpl< T, NDIM >
• print_plane_local() : madness::FunctionImpl< T, NDIM >
• print_potential_matrix_eigs() : madness::Solver< T, NDIM >
• print_precedence() : madness::QCParameter
• print_priority_and_status_to_string() : madness::MacroTaskBase
• print_psdot() : madness::trajectory< NDIM >
• print_ranks() : madness::PNO
• print_setup() : madness::printleveler
• print_size() : madness::CC_vecfunction, madness::CCPairFunction< T, NDIM >, madness::Cloud, madness::Function< T, NDIM >, madness::FunctionImpl< T, NDIM >, madness::TwoBodyFunctionComponentBase, madness::TwoBodyFunctionPureComponent< T, NDIM >, madness::TwoBodyFunctionSeparatedComponent< T, NDIM >
• print_sizes() : DF
• print_stats() : madness::ConcurrentHashMap< keyT, valueT, hashfunT >, madness::FunctionImpl< T, NDIM >
• print_success_fail() : madness::test_output
• print_taskq() : madness::MacroTaskQ
• print_tensor2d() : madness::Solver< T, NDIM >
• print_timer() : madness::Exchange< T, NDIM >::ExchangeImpl< T, NDIM >, madness::FunctionImpl< T, NDIM >, madness::SeparatedConvolution< Q, NDIM >
• print_timings() : madness::Cloud, madness::printleveler
• print_to_string() : madness::QCCalculationParametersBase
• print_tree() : madness::Function< T, NDIM >, madness::FunctionImpl< T, NDIM >, madness::LoadBalanceDeux< NDIM >
• print_tree_graphviz() : madness::Function< T, NDIM >, madness::FunctionImpl< T, NDIM >
• print_tree_json() : madness::Function< T, NDIM >, madness::FunctionImpl< T, NDIM >
• print_type_in_compilation_error() : madness::FunctionImpl< T, NDIM >
• print_warnings() : madness::CCMessenger
• print_xfunctions() : madness::TDHF
• printdebug() : madness::Exchange< T, NDIM >::ExchangeImpl< T, NDIM >, madness::MacroTaskQ
• printlevel() : madness::Complex_CIS_Parameters, madness::Nemo_complex_Parameters
• printleveler() : madness::printleveler
• printout() : EmbeddedDirichlet
• printprogress() : madness::MacroTaskQ
• printtest() : madness::MolecularOptimizationParameters
• printtimings() : madness::MacroTaskQ
• probe() : madness::DependencyInterface, madness::Future< T >, madness::Future< std::vector< Future< T > > >, madness::Future< void >, madness::FutureImpl< T >, madness::WorldContainer< keyT, valueT, hashfunT >, madness::WorldContainerImpl< keyT, valueT, hashfunT >
• ProbeAllDone() : madness::WorldTaskQueue::ProbeAllDone
• probing_displacement() : madness::BoxSurfaceDisplacementRange< NDIM >
• proc() : madness::ProcessKey< Key, Tag >
• process_coldim() : madness::DistributedMatrixDistribution
• process_pending() : madness::WorldContainer< keyT, valueT, hashfunT >, madness::WorldObject< Derived >
• process_rowdim() : madness::DistributedMatrixDistribution
• process_some() : madness::RMI::RmiTask
• ProcessKey() : madness::ProcessKey< Key, Tag >
• product() : madness::Tensor< T >, madness::WorldGopInterface
• profiler() : madness::ThreadPoolThread
• ProfileStat() : madness::ProfileStat< T >
• project() : madness::FunctionImpl< T, NDIM >, madness::LowRankFunctionFactory< T, NDIM, LDIM >, madness::SCF
• project_ao() : madness::MolecularOrbitals< T, NDIM >
• project_ao_basis() : madness::SCF, madness::Solver< T, NDIM >
• project_ao_basis_only() : madness::SCF
• project_on_irreps() : madness::projector_irrep
• project_out() : madness::CCPairFunction< T, NDIM >, madness::Function< T, NDIM >, madness::FunctionImpl< T, NDIM >
• project_out2() : madness::FunctionImpl< T, NDIM >
• project_out_decomposed() : madness::CCPairFunction< T, NDIM >
• project_out_op() : madness::FunctionImpl< T, NDIM >::project_out_op< LDIM >
• project_out_op_decomposed() : madness::CCPairFunction< T, NDIM >
• project_potential_basis() : Calculation
• project_refine_op() : madness::FunctionImpl< T, NDIM >
• Projector() : madness::Projector< T, NDIM >
• projector_external_dof() : madness::MolecularOptimizer
• projector_irrep() : madness::projector_irrep
• ProjRLMFunctor() : madness::ProjRLMFunctor
• ProjRLMStore() : madness::ProjRLMStore
• property() : madness::ResponseParameters
• PropertyBase() : PropertyBase
• protocol() : madness::CalculationParameters, madness::PNOParameters, madness::ResponseParameters
• provides_coeff() : madness::CompositeFunctorInterface< T, NDIM, MDIM >, madness::FunctionFunctorInterface< T, NDIM >, madness::FunctionInterface< T, NDIM, opT >, madness::TwoElectronInterface< T, NDIM >
• provides_gradient() : CoreFittingTarget, Fred, madness::HartreeFock< T, NDIM >, madness::MolecularEnergy, madness::Nemo, madness::OptimizationTargetInterface, OptimizationTargetInterface, Test2, Test
• provides_jacobian() : madness::SolverTargetInterface, SolverTargetInterface
• prune_small_coefficients() : madness::GFit< T, NDIM >
• PseudoNuclearCorrelationFactor() : madness::PseudoNuclearCorrelationFactor
• PsiExact() : PsiExact
• psivalue() : ExactSpinor
• psp_calc() : madness::Molecule::GeometryParameters
• PthreadConditionVariable() : madness::PthreadConditionVariable
• ptr() : madness::GenTensor< T >, madness::Mutex, madness::RecursiveMutex, madness::Tensor< T >, madness::TensorTrain< T >
• ptr_from_id() : madness::World
• pure() : madness::CCPairFunction< T, NDIM >
• pure_ae() : madness::Molecule::GeometryParameters
• purify_hessian() : madness::Nemo
• push() : madness::Stack< T, N >
• push_back() : madness::DQueue< T >, madness::response_space, madness::X_space
• push_back_with_lock() : madness::DQueue< T >
• push_front() : madness::DQueue< T >
• push_front_with_lock() : madness::DQueue< T >
• put_in_box() : madness::FunctionImpl< T, NDIM >
• PWFunctor() : PWFunctor