Here is a list of all class members with links to the classes they belong to:
- m -
- m : occ::gto::Momenta, occ::gto::MomentaSpherical
- m_atoms : occ::qm::SCFMethodBase
- m_charge : occ::qm::SCFMethodBase
- m_crystal : occ::driver::CrystalGrowthCalculator
- m_crystal_interaction_energies : occ::driver::CrystalGrowthCalculator
- m_D : quickhull::Plane< T >
- m_dimer_energies : occ::driver::CrystalGrowthCalculator, occ::driver::XTBCrystalGrowthCalculator
- m_disabledFaces : quickhull::MeshBuilder< T >
- m_disabledHalfEdges : quickhull::MeshBuilder< T >
- m_endVertex : quickhull::HalfEdgeMesh< FloatType, IndexType >::HalfEdge, quickhull::MeshBuilder< T >::HalfEdge
- m_face : quickhull::HalfEdgeMesh< FloatType, IndexType >::HalfEdge, quickhull::MeshBuilder< T >::HalfEdge
- m_faces : quickhull::HalfEdgeMesh< FloatType, IndexType >, quickhull::MeshBuilder< T >
- m_failedHorizonEdges : quickhull::DiagnosticsData
- m_frozen_electrons : occ::qm::SCFMethodBase
- m_full_dimers : occ::driver::CrystalGrowthCalculator
- m_gas_phase_energies : occ::driver::XTBCrystalGrowthCalculator
- m_gas_phase_wavefunctions : occ::driver::CrystalGrowthCalculator
- m_halfEdgeIndex : quickhull::HalfEdgeMesh< FloatType, IndexType >::Face
- m_halfEdges : quickhull::HalfEdgeMesh< FloatType, IndexType >, quickhull::MeshBuilder< T >
- m_have_initial_guess : occ::qm::SCF< Procedure >
- m_he : quickhull::MeshBuilder< T >::Face
- m_horizonEdgesOnCurrentIteration : quickhull::MeshBuilder< T >::Face
- m_inFaceStack : quickhull::MeshBuilder< T >::Face
- m_interaction_energies : occ::driver::CrystalGrowthCalculator
- m_isVisibleFaceOnCurrentIteration : quickhull::MeshBuilder< T >::Face
- m_lattice_energies : occ::driver::CrystalGrowthCalculator
- m_molecules : occ::driver::CrystalGrowthCalculator
- m_mostDistantPoint : quickhull::MeshBuilder< T >::Face
- m_mostDistantPointDist : quickhull::MeshBuilder< T >::Face
- m_nearest_dimers : occ::driver::CrystalGrowthCalculator
- m_next : quickhull::HalfEdgeMesh< FloatType, IndexType >::HalfEdge, quickhull::MeshBuilder< T >::HalfEdge
- m_num_electrons : occ::qm::SCFMethodBase
- m_num_frozen : occ::qm::SCFMethodBase
- m_opp : quickhull::HalfEdgeMesh< FloatType, IndexType >::HalfEdge, quickhull::MeshBuilder< T >::HalfEdge
- m_P : quickhull::MeshBuilder< T >::Face
- m_partial_charges : occ::driver::XTBCrystalGrowthCalculator
- m_pointsOnPositiveSide : quickhull::MeshBuilder< T >::Face
- m_procedure : occ::qm::SCF< Procedure >
- m_S : quickhull::Ray< T >
- m_solution_terms : occ::driver::CrystalGrowthCalculator
- m_solvated_dimer_energies : occ::driver::XTBCrystalGrowthCalculator
- m_solvated_energies : occ::driver::XTBCrystalGrowthCalculator
- m_solvated_surface_properties : occ::driver::CrystalGrowthCalculator
- m_solvated_wavefunctions : occ::driver::CrystalGrowthCalculator
- m_solvation_breakdowns : occ::driver::CrystalGrowthCalculator
- m_sqrNLength : quickhull::Plane< T >
- m_V : quickhull::Ray< T >
- m_vertices : quickhull::HalfEdgeMesh< FloatType, IndexType >
- m_VInvLengthSquared : quickhull::Ray< T >
- m_visibilityCheckedOnIteration : quickhull::MeshBuilder< T >::Face
- map_interactions() : occ::cg::InteractionMapper
- MarchingCubes() : occ::geometry::mc::MarchingCubes
- mass() : occ::core::Element
- max_angular_points : occ::io::BeckeGridSettings
- max_depth : occ::geometry::mc::LinearHashedMarchingCubes, occ::main::IsosurfaceConfig
- max_ecp_shell_size() : occ::qm::AOBasis
- max_error() : occ::qm::CDIIS
- max_exponent() : occ::qm::Shell
- max_facets : occ::main::CGConfig
- max_iter : occ::core::opt::Bracket1D< Function >
- max_ln_coefficient : occ::qm::Shell
- max_radius : occ::interaction::LatticeConvergenceSettings, occ::main::DimerGenerationSettings
- max_shell_size() : occ::qm::AOBasis
- maximum() : occ::crystal::HKL
- maximum_distance_heuristic() : occ::slater::PromoleculeDensity
- maxiter : occ::qm::SCF< Procedure >
- MCDeformationDensityFunctor() : occ::isosurface::MCDeformationDensityFunctor
- MCElectricPotentialFunctor() : occ::isosurface::MCElectricPotentialFunctor
- MCElectronDensityFunctor() : occ::isosurface::MCElectronDensityFunctor
- MCPromoleculeDensityFunctor() : occ::isosurface::MCPromoleculeDensityFunctor
- mean : occ::isosurface::SurfaceCurvature
- mean_curvature : occ::isosurface::Isosurface
- merge() : occ::isosurface::IsosurfaceProperties, occ::qm::AOBasis
- MeshBuilder() : quickhull::MeshBuilder< T >
- method : occ::cg::SMDSettings, occ::interaction::CEParameterizedModel, occ::io::GaussianInputFile, occ::io::OccInput, occ::io::QCSchemaModel, occ::qm::Wavefunction
- Method : occ::xtb::TbliteCalculator, occ::xtb::XTBCalculator
- method_string() : occ::dft::DFT
- method_type : occ::io::GaussianInputFile
- MethodType : occ::io::GaussianInputFile
- metric_tensor() : occ::crystal::UnitCell
- MGGA : occ::dft::DensityFunctional
- mgga_c_bc95 : occ::dft::DensityFunctional
- mgga_c_cc06 : occ::dft::DensityFunctional
- mgga_c_cs : occ::dft::DensityFunctional
- mgga_c_dldf : occ::dft::DensityFunctional
- mgga_c_m05 : occ::dft::DensityFunctional
- mgga_c_m05_2x : occ::dft::DensityFunctional
- mgga_c_m06 : occ::dft::DensityFunctional
- mgga_c_m06_2x : occ::dft::DensityFunctional
- mgga_c_m06_hf : occ::dft::DensityFunctional
- mgga_c_m06_l : occ::dft::DensityFunctional
- mgga_c_m08_hx : occ::dft::DensityFunctional
- mgga_c_m08_so : occ::dft::DensityFunctional
- mgga_c_m11 : occ::dft::DensityFunctional
- mgga_c_m11_l : occ::dft::DensityFunctional
- mgga_c_mn12_l : occ::dft::DensityFunctional
- mgga_c_mn12_sx : occ::dft::DensityFunctional
- mgga_c_mn15 : occ::dft::DensityFunctional
- mgga_c_mn15_l : occ::dft::DensityFunctional
- mgga_c_pkzb : occ::dft::DensityFunctional
- mgga_c_r2scan : occ::dft::DensityFunctional
- mgga_c_revtpss : occ::dft::DensityFunctional
- mgga_c_scan : occ::dft::DensityFunctional
- mgga_c_tpss : occ::dft::DensityFunctional
- mgga_c_tpssloc : occ::dft::DensityFunctional
- mgga_c_vsxc : occ::dft::DensityFunctional
- mgga_x_2d_prhg07 : occ::dft::DensityFunctional
- mgga_x_2d_prhg07_prp10 : occ::dft::DensityFunctional
- mgga_x_bj06 : occ::dft::DensityFunctional
- mgga_x_bloc : occ::dft::DensityFunctional
- mgga_x_br89 : occ::dft::DensityFunctional
- mgga_x_gvt4 : occ::dft::DensityFunctional
- mgga_x_lta : occ::dft::DensityFunctional
- mgga_x_m05 : occ::dft::DensityFunctional
- mgga_x_m05_2x : occ::dft::DensityFunctional
- mgga_x_m06 : occ::dft::DensityFunctional
- mgga_x_m06_hf : occ::dft::DensityFunctional
- mgga_x_m06_l : occ::dft::DensityFunctional
- mgga_x_m08_hx : occ::dft::DensityFunctional
- mgga_x_m08_so : occ::dft::DensityFunctional
- mgga_x_m11 : occ::dft::DensityFunctional
- mgga_x_m11_l : occ::dft::DensityFunctional
- mgga_x_mbeef : occ::dft::DensityFunctional
- mgga_x_mbeefvdw : occ::dft::DensityFunctional
- mgga_x_mk00 : occ::dft::DensityFunctional
- mgga_x_mk00b : occ::dft::DensityFunctional
- mgga_x_mn12_l : occ::dft::DensityFunctional
- mgga_x_mn15_l : occ::dft::DensityFunctional
- mgga_x_modtpss : occ::dft::DensityFunctional
- mgga_x_ms0 : occ::dft::DensityFunctional
- mgga_x_ms1 : occ::dft::DensityFunctional
- mgga_x_ms2 : occ::dft::DensityFunctional
- mgga_x_mvs : occ::dft::DensityFunctional
- mgga_x_pkzb : occ::dft::DensityFunctional
- mgga_x_r2scan : occ::dft::DensityFunctional
- mgga_x_revtpss : occ::dft::DensityFunctional
- mgga_x_rpp09 : occ::dft::DensityFunctional
- mgga_x_scan : occ::dft::DensityFunctional
- mgga_x_tau_hcth : occ::dft::DensityFunctional
- mgga_x_tb09 : occ::dft::DensityFunctional
- mgga_x_tpss : occ::dft::DensityFunctional
- mgga_xc_b97m_v : occ::dft::DensityFunctional
- mgga_xc_otpss_d : occ::dft::DensityFunctional
- mgga_xc_tpsslyp1w : occ::dft::DensityFunctional
- mgga_xc_zlp : occ::dft::DensityFunctional
- min_angular_points : occ::io::BeckeGridSettings
- min_depth : occ::geometry::mc::LinearHashedMarchingCubes
- min_error() : occ::qm::CDIIS
- min_exponent() : occ::qm::Shell
- min_radius : occ::interaction::LatticeConvergenceSettings
- minimum() : occ::crystal::HKL
- MIXED : occ::io::FchkWriter
- mo : occ::qm::SCFContext, occ::qm::Wavefunction
- mo_index : occ::main::ElectronDensityFunctor
- mo_number : occ::main::CubeConfig
- model : occ::interaction::PairEnergy, occ::io::QCSchemaInput
- model_name : occ::interaction::LatticeConvergenceSettings, occ::io::PairInput, occ::main::OccPairInput
- molar_mass() : occ::core::Molecule
- MoldenReader() : occ::io::MoldenReader
- molecular_orbitals() : occ::qm::SCF< Procedure >
- MolecularGrid() : occ::dft::MolecularGrid
- MolecularGridPoints() : occ::dft::MolecularGridPoints
- MolecularOrbitals() : occ::qm::MolecularOrbitals
- MolecularPointGroup() : occ::core::MolecularPointGroup
- Molecule() : occ::core::Molecule
- molecule() : occ::io::DftbGenFormat, occ::io::GeometryInput, occ::isosurface::VoidSurfaceFunctor
- molecule_index : occ::cg::NeighborAtoms
- molecule_neighbors : occ::crystal::CrystalDimers
- molecule_results : occ::cg::CrystalGrowthResult
- molecule_site_mapping_table() : occ::crystal::Crystal
- MoleculeNeighbors : occ::crystal::CrystalDimers
- MoleculeOrder : occ::core::Dimer
- molecules : occ::crystal::SurfaceCutResult, occ::driver::CrystalGrowthCalculator
- moments() : occ::xdm::XDM, occ::xdm::XDMAtomList
- monomer_a : occ::main::OccPairInput
- monomer_b : occ::main::OccPairInput
- monomer_directory : occ::main::OccPairInput
- morphology_kind() : occ::io::GMFWriter
- mp2_density_matrix() : occ::io::FchkReader
- mu : occ::qm::OrbitalSmearing
- mulliken_charges() : occ::qm::Wavefunction
- multiplicity() : occ::core::Dimer, occ::core::Molecule, occ::io::ElectronInput, occ::io::GaussianInputFile, occ::io::QCSchemaTopology, occ::qm::SCF< Procedure >, occ::qm::Wavefunction
- MultiplicityValidator() : occ::main::MultiplicityValidator
- multiply() : occ::core::Fraction
- multipole() : occ::qm::IntegralEngine
- multipoles() : occ::dft::HirshfeldPartition