cclib-svn

[cclib-svn] SF.net SVN: cclib: [790] trunk/test

[<la...@us...>]

Revision: 790
          http://cclib.svn.sourceforge.net/cclib/?rev=790&view=rev
Author:   langner
Date:     2007-11-06 01:14:32 -0800 (Tue, 06 Nov 2007)

Log Message:
-----------
ORCA: pass all symmetry tests since the program knows none; modify basisdict and b3lypenerhy where appropriate since the tests were run in 3-21G instead of STO-3G.

Modified Paths:
--------------
    trunk/test/testGeoOpt.py
    trunk/test/testSP.py
    trunk/test/testSPun.py


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[cclib-svn] SF.net SVN: cclib: [799] trunk/test

[<bao...@us...>]

Revision: 799
          http://cclib.svn.sourceforge.net/cclib/?rev=799&view=rev
Author:   baoilleach
Date:     2007-11-18 11:55:03 -0800 (Sun, 18 Nov 2007)

Log Message:
-----------
tests: More testing of the triplet excitations...(note to self: still need to sort out that CI stuff...)

Modified Paths:
--------------
    trunk/test/testTD.py
    trunk/test/testdata


This was sent by the SourceForge.net collaborative development platform, the world's largest Open Source development site.