:orphan:
 

.. index:: **ANALYZE
.. _**ANALYZE:

===========
\*\*ANALYZE
===========

Wave function analyzing tool.

This section is aimed to analyze the final Hartree-Fock wave function by
using one or more analysis modules. By default none of them is
activated.


.. index:: .PRIVEC
.. _ANALYZE_.PRIVEC:

.PRIVEC
-------

Print vectors. Activates the :ref:`*PRIVEC` subsection.


.. index:: .MULPOP
.. _ANALYZE_.MULPOP:

.MULPOP
-------

Perform Mulliken population analysis :cite:`Mulliken1955`.
Continues to :ref:`*MULPOP` subsection.


.. index:: .PROJECTION
.. _ANALYZE_.PROJECTION:

.PROJECTION
-----------

Perform projection analysis :cite:`Faegri2001` Activates the :ref:`*PROJECTION`
subsection.


.. index:: .DENSITY
.. _ANALYZE_.DENSITY:

.DENSITY
--------

Write density to a formatted file in Gaussian cube format. Activates the
:ref:`*DENSITY` subsection.


.. index:: .LOCALIZATION
.. _ANALYZE_.LOCALIZATION:

.LOCALIZATION
-------------

Localize orbitals using the Pipek-Mezey criterion :cite:`Dubillard2006` .

Continues to the activated :ref:`*LOCALIZATION`
subsection. Note that in the present implementation this only works in 
:math:`C_1` symmetry.