qs_subsys_types.F File Reference

#include "./base/base_uses.f90"

Go to the source code of this file.

Modules
module	qs_subsys_types
	types that represent a quickstep subsys

Functions/Subroutines
subroutine, public	qs_subsys_types::qs_subsys_release (subsys)
	releases a subsys (see doc/ReferenceCounting.html) More...
subroutine, public	qs_subsys_types::qs_subsys_get (subsys, atomic_kinds, atomic_kind_set, particles, particle_set, local_particles, molecules, molecule_set, molecule_kinds, molecule_kind_set, local_molecules, para_env, colvar_p, shell_particles, core_particles, gci, multipoles, natom, nparticle, ncore, nshell, nkind, atprop, virial, results, cell, cell_ref, use_ref_cell, energy, force, qs_kind_set, cp_subsys, nelectron_total, nelectron_spin)
	... More...
subroutine, public	qs_subsys_types::qs_subsys_set (subsys, cp_subsys, local_particles, local_molecules, cell, cell_ref, use_ref_cell, energy, force, qs_kind_set, nelectron_total, nelectron_spin)
	... More...