.. _file_commands_thermo_command.h:

File thermo_command.h
=====================

|exhale_lsh| :ref:`Parent directory <dir_commands>` (``commands``)

.. |exhale_lsh| unicode:: U+021B0 .. UPWARDS ARROW WITH TIP LEFTWARDS



Defines the :ref:`exhale_class_classThermoCommand` class for advanced thermodynamic analysis. 


Definition (``commands/thermo_command.h``)
------------------------------------------




Detailed Description
--------------------

Le Nhan Pham 

2026

The :ref:`exhale_class_classThermoCommand` integrates the :ref:`namespace_OpenThermo` module logic, enabling users to perform post-calculation thermodynamic adjustments out of the standard Gaussian workflow. This includes scaling vibrational frequencies, changing temperatures/pressures, and swapping isotopes. 




Includes
--------


- ``commands/icommand.h`` (:ref:`file_commands_icommand.h`)

- ``thermo/thermo.h`` (:ref:`file_thermo_thermo.h`)






Classes
-------


- :ref:`exhale_class_classThermoCommand`