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molecule_types::molecule_type Type Reference

Data Fields

type(molecule_kind_type), pointer molecule_kind => NULL()
 
type(local_states_type), dimension(:), pointer lmi => NULL()
 
type(local_constraint_type), pointer lci => NULL()
 
integer first_atom = 0
 
integer last_atom = 0
 
integer first_shell = 0
 
integer last_shell = 0
 

Detailed Description

Definition at line 110 of file molecule_types.F.

Field Documentation

◆ molecule_kind

type(molecule_kind_type), pointer molecule_types::molecule_type::molecule_kind => NULL()

Definition at line 111 of file molecule_types.F.

◆ lmi

type(local_states_type), dimension(:), pointer molecule_types::molecule_type::lmi => NULL()

Definition at line 112 of file molecule_types.F.

◆ lci

type(local_constraint_type), pointer molecule_types::molecule_type::lci => NULL()

Definition at line 113 of file molecule_types.F.

◆ first_atom

integer molecule_types::molecule_type::first_atom = 0

Definition at line 114 of file molecule_types.F.

◆ last_atom

integer molecule_types::molecule_type::last_atom = 0

Definition at line 115 of file molecule_types.F.

◆ first_shell

integer molecule_types::molecule_type::first_shell = 0

Definition at line 116 of file molecule_types.F.

◆ last_shell

integer molecule_types::molecule_type::last_shell = 0

Definition at line 117 of file molecule_types.F.


The documentation for this type was generated from the following file: