r21719 - /trunk/test_suite/shared_data/structures/strychnine_opt_cdcl3_b3lyp_J_gaussian.log -- November 29, 2013 - 14:47

Author: bugman
Date: Fri Nov 29 14:47:36 2013
New Revision: 21719

URL: http://svn.gna.org/viewcvs/relax?rev=21719&view=rev
Log:
Added a Gaussian DFT optimisation log file to the shared data directories.

This will be used to test the reading of structural data from Gaussian files.


Added:
    
trunk/test_suite/shared_data/structures/strychnine_opt_cdcl3_b3lyp_J_gaussian.log

[This mail would be too long, it was shortened to contain the URLs only.]

Added: 
trunk/test_suite/shared_data/structures/strychnine_opt_cdcl3_b3lyp_J_gaussian.log
URL: 
http://svn.gna.org/viewcvs/relax/trunk/test_suite/shared_data/structures/strychnine_opt_cdcl3_b3lyp_J_gaussian.log?rev=21719&view=auto