(git:58e3e09)
fist_environment_types.F File Reference

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Modules

module  fist_environment_types
 

Functions/Subroutines

subroutine, public fist_environment_types::fist_env_get (fist_env, atomic_kind_set, particle_set, ewald_pw, local_particles, local_molecules, molecule_kind_set, molecule_set, cell, cell_ref, ewald_env, fist_nonbond_env, thermo, para_env, subsys, qmmm, qmmm_env, input, shell_model, shell_model_ad, shell_particle_set, core_particle_set, multipoles, results, exclusions, efield)
 Purpose: Get the FIST environment. More...
 
subroutine, public fist_environment_types::fist_env_set (fist_env, atomic_kind_set, particle_set, ewald_pw, local_particles, local_molecules, molecule_kind_set, molecule_set, cell_ref, ewald_env, fist_nonbond_env, thermo, subsys, qmmm, qmmm_env, input, shell_model, shell_model_ad, exclusions, efield)
 Set the FIST environment. More...
 
subroutine, public fist_environment_types::fist_env_create (fist_env, para_env)
 allocates and intitializes a fist_env More...
 
subroutine, public fist_environment_types::fist_env_release (fist_env)
 releases the given fist_env (see doc/ReferenceCounting.html) More...