sc::cadf::assignments::AtomCluster Struct Reference

Inheritance diagram for sc::cadf::assignments::AtomCluster:

Public Member Functions
void	assign_atom (const boost::shared_ptr< AssignableAtom > &atom)
boost::shared_ptr< Node >	use_node (int inode, bool is_me)
uli	workload_per_node ()
void	make_assignments ()
bool	has_local_coefs_for_atom (uint atom_index)

Public Attributes
ptr_set< boost::shared_ptr< AssignableAtom >, detail::index_less >	atoms
std::vector< boost::shared_ptr< Node > >	nodes
Assignments *	parent
uli	coefs_size = 0
int	index
uli	dfnsh = 0
std::set< uint >	assigned_dfbs_shells
std::unordered_map< uint, uint >	dfbs_shell_map
std::unordered_map< uint, uli >	coef_offsets

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The documentation for this struct was generated from the following file:

• src/lib/chemistry/qc/scf/cadf/assignments.h