Paul Fleurat-Lessard
- Email :
- Inscrit le : 05/11/2010
- Dernière connexion : 08/02/2018
Projets
- OpenPath (Manager, 26/01/2011)
- Opt'n Path (Manager, 02/12/2011)
- QMX (Manager, 16/03/2011)
- scripts_chimie4psmn (Manager, Developer, 11/04/2016)
Activité
Demandes soumises : 0
05/03/2014
- Opt'n Path v1.50. License is now clearly AGPL. Unused files deleted.
- 21:13 Opt'n Path Révision 12: v1.50 at last ! Unused files deleted. Licence is now clearly AGPL
- (GNU Affero General Public License)
23/09/2013
- 11:36 Opt'n Path Révision 11: Some bugs corrected.
25/06/2013
- 10:52 Opt'n Path Révision 10: Periodic calculations are now handled for Siesta, Mopac and Gaussian.
- Some bugs have also been corrected.
19/03/2013
- 15:46 Opt'n Path Révision 9: Documentation has been improved in Mini_help, as well as in Path.f90.
- A bug corrected in geometry optimization for cartesian coordinates.
28/02/2013
- 13:30 Opt'n Path Révision 8: Siesta is working, and I have added one example for it.
- The main update here is that geometrical changes can now be monitored directly
in Opt'n Path using AnaGeom and GeomFi...
27/02/2013
- 13:39 Opt'n Path Révision 7: Another intermediate upgrade. AnaPath is being integrated into Opt'n Path directly.
25/02/2013
- 20:30 Opt'n Path Révision 6: Last part of Siesta input reading is done. Siesta should now workd fully.
- 18:00 Opt'n Path Révision 5: This is an intermediate update (kind of v1.47-v1.48) with an experimental support of...
- On top of this, I have cleaned some routines: Read_geom.f90 and ReadInput.f90 are 'interface' routines
that call the...
16/11/2012
- 16:26 Opt'n Path Révision 4: Cosmetic changes.
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