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gopt_f_types.F File Reference

Go to the source code of this file.

Data Types

type  gopt_f_types::gopt_f_type
 calculates the potential energy of a system, and its derivatives More...
 

Modules

module  gopt_f_types
 contains a functional that calculates the energy and its derivatives for the geometry optimizer
 

Functions/Subroutines

recursive subroutine, public gopt_f_types::gopt_f_create (gopt_env, gopt_param, force_env, globenv, geo_opt_section, eval_opt_geo)
 ...
 
subroutine, public gopt_f_types::gopt_f_retain (gopt_env)
 ...
 
recursive subroutine, public gopt_f_types::gopt_f_release (gopt_env)
 ...