occ::dft::MolecularGridPoints Member List

This is the complete list of members for occ::dft::MolecularGridPoints, including all inherited members.

atom_blocks() const	occ::dft::MolecularGridPoints
clear_hierarchy()	occ::dft::MolecularGridPoints	inline
get_atom_grid(size_t atom_idx, uint_fast8_t atomic_number) const	occ::dft::MolecularGridPoints
get_hierarchy(const SpatialHierarchySettings &settings={}) const	occ::dft::MolecularGridPoints
has_hierarchy() const	occ::dft::MolecularGridPoints	inline
initialize_from_atom_grids(const std::vector< AtomGrid > &atom_grids)	occ::dft::MolecularGridPoints
MolecularGridPoints()=default	occ::dft::MolecularGridPoints
MolecularGridPoints(const Mat3N &points, const Vec &weights, const std::vector< std::pair< size_t, size_t > > &atom_blocks)	occ::dft::MolecularGridPoints
MolecularGridPoints(const std::vector< AtomGrid > &atom_grids)	occ::dft::MolecularGridPoints
num_atoms() const	occ::dft::MolecularGridPoints
num_points() const	occ::dft::MolecularGridPoints
points() const	occ::dft::MolecularGridPoints
points_for_atom(size_t atom_idx) const	occ::dft::MolecularGridPoints
weights() const	occ::dft::MolecularGridPoints
weights_for_atom(size_t atom_idx) const	occ::dft::MolecularGridPoints