#include <iostream>
#include <memory>
#include <vector>
#include "mpqc/chemistry/molecule/cluster_collapse.h"
#include "mpqc/chemistry/molecule/cluster_concept.h"
#include "mpqc/chemistry/molecule/fwd.h"
#include "mpqc/util/meta/sfinae.h"

Include dependency graph for atom_based_cluster_concept.h:

This graph shows which files directly or indirectly include this file:

Classes
class	mpqc::AtomBasedClusterConcept

class	mpqc::AtomBasedClusterModel< T >

class	mpqc::AtomBasedClusterable
	The AtomBasedClusterable is a class that holds any clusterable type that is built up from atoms. More...

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

Functions
double	mpqc::mass (AtomBasedClusterable const &ac)

int64_t	mpqc::total_atomic_number (AtomBasedClusterable const &ac)

size_t	mpqc::natoms (AtomBasedClusterable const &ac)

Vector3d const &	mpqc::center (AtomBasedClusterable const &ac)

Vector3d const &	mpqc::center_of_mass (AtomBasedClusterable const &ac)

std::vector< Atom >	mpqc::collapse_to_atoms (AtomBasedClusterable const &ac)

void	mpqc::update (AtomBasedClusterable &ac, const std::vector< Atom > &atoms, size_t &pos)

void	mpqc::apply (AtomBasedClusterable &ac, const std::function< void(Atom &)> &op)

Classes

Namespaces

Functions