From adc82bb35ef054fe5de35c99347ad09e052bff38 Mon Sep 17 00:00:00 2001 From: Thomas Applencourt Date: Fri, 3 Jul 2015 12:40:48 +0200 Subject: [PATCH] Maj the doc for loc_cele --- plugins/loc_cele/README.rst | 9 ++++----- plugins/loc_cele/loc_cele.irp.f | 25 ++++++------------------- 2 files changed, 10 insertions(+), 24 deletions(-) diff --git a/plugins/loc_cele/README.rst b/plugins/loc_cele/README.rst index b9a97efe..2db141ee 100644 --- a/plugins/loc_cele/README.rst +++ b/plugins/loc_cele/README.rst @@ -1,7 +1,3 @@ -=============== -loc_cele Module -=============== - Documentation ============= @@ -9,7 +5,10 @@ Documentation .. by the `update_README.py` script. `loc_rasorb `_ - 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 ============== diff --git a/plugins/loc_cele/loc_cele.irp.f b/plugins/loc_cele/loc_cele.irp.f index 5b9112ca..7cb1797d 100644 --- a/plugins/loc_cele/loc_cele.irp.f +++ b/plugins/loc_cele/loc_cele.irp.f @@ -2,25 +2,12 @@ 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