ipi_environment_types.F File Reference

#include "./base/base_uses.f90"

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Data Types
type	ipi_environment_types::ipi_environment_type
	The i–PI environment. More...

Modules
module	ipi_environment_types
	The environment for the empirical interatomic potential methods.

Functions/Subroutines
subroutine, public	ipi_environment_types::ipi_env_release (ipi_env)
	Releases the given ipi environment (see doc/ReferenceCounting.html)
subroutine, public	ipi_environment_types::ipi_env_get (ipi_env, ipi_energy, ipi_forces, subsys, atomic_kind_set, particle_set, local_particles, molecule_kind_set, molecule_set, local_molecules, force_env_input, cell, cell_ref, virial, sockfd)
	Returns various attributes of the ipi environment.
subroutine, public	ipi_environment_types::ipi_env_set (ipi_env, ipi_energy, ipi_forces, subsys, atomic_kind_set, particle_set, local_particles, molecule_kind_set, molecule_set, local_molecules, force_env_input, cell_ref, sockfd)
	Sets various attributes of the ipi environment.
subroutine, public	ipi_environment_types::ipi_env_create (ipi_env)
	Creates the ipi environment.