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mirror of https://github.com/LCPQ/quantum_package synced 2024-06-02 11:25:26 +02:00

Maj the doc for loc_cele

This commit is contained in:
Thomas Applencourt 2015-07-03 12:40:48 +02:00
parent f93eeac8e2
commit adc82bb35e
2 changed files with 10 additions and 24 deletions

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===============
loc_cele Module
===============
Documentation
=============
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.. by the `update_README.py` script.
`loc_rasorb <http://github.com/LCPQ/quantum_package/tree/master/src/loc_cele/loc_cele.irp.f#L1>`_
Undocumented
This program performs a localization of the active orbitals
of a CASSCF wavefunction, reading the orbitals from a RASORB
file of molcas.
id1=max number of MO in a given symmetry.
Needed Modules
==============

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implicit none
!
! This program performs a localization of the active orbitals
! of a CASSCF wavefunction, reading the orbitals from a RASORB
! file of molcas.
!
! id1=max number of MO in a given symmetry.
!
BEGIN_DOC
! This program performs a localization of the active orbitals
! of a CASSCF wavefunction, reading the orbitals from a RASORB
! file of molcas.
! id1=max number of MO in a given symmetry.
END_DOC
integer id1