MCTC-library
Formats
Source Files
Modules
Procedures
Abstract Interfaces
Derived Types
Program
mctc_io_write_qchem
Module
28 statements
Source File
qchem.f90
mctc_io_write_qchem
Contents
Subroutines
write_qchem
Uses
mctc_io_structure
mctc_env_accuracy
mctc_io_convert
Subroutines
public subroutine
write_qchem
(self, unit)
Arguments
Type
Intent
Optional
Attributes
Name
class(
structure_type
),
intent(in)
::
self
Instance of the molecular structure data
integer,
intent(in)
::
unit
File handle