#include "mpqc/chemistry/molecule/atom_based_cluster.h"
#include "mpqc/chemistry/molecule/common.h"
#include "mpqc/util/core/formio.h"

Include dependency graph for atom_based_cluster.cpp:

Namespaces
	mpqc
	The top-level namespace for all Massively Parallel Quantum Chemistry package.

Functions
void	mpqc::update (AtomBasedCluster &abc, const std::vector< Atom > &atoms, size_t &pos)


std::vector< Atom >	mpqc::collapse_to_atoms (AtomBasedCluster const &abc)

void	mpqc::apply (AtomBasedCluster &abc, const std::function< void(Atom &)> &op)

std::ostream &	mpqc::operator<< (std::ostream &, AtomBasedCluster const &)
	print the cluster by printing each of its elements More...

Namespaces

Functions