cclib-svn

[cclib-svn] SF.net SVN: cclib: [375] trunk/data/regressionfiles.txt

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

Revision: 375
          http://svn.sourceforge.net/cclib/?rev=375&view=rev
Author:   baoilleach
Date:     2006-10-22 12:01:34 -0700 (Sun, 22 Oct 2006)

Log Message:
-----------
New data file: Have added Fe-ox3-final.out, an ADF file with a homos problem.

Modified Paths:
--------------
    trunk/data/regressionfiles.txt


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[cclib-svn] SF.net SVN: cclib: [607] trunk/data/regressionfiles.txt

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

Revision: 607
          http://svn.sourceforge.net/cclib/?rev=607&view=rev
Author:   baoilleach
Date:     2007-03-30 03:22:14 -0700 (Fri, 30 Mar 2007)

Log Message:
-----------
Added Adam's Au2-fixed.adfout.gz to regressionfiles.txt. It's parsed correctly, but overall two parse errors remain.

Modified Paths:
--------------
    trunk/data/regressionfiles.txt


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[cclib-svn] SF.net SVN: cclib: [647] trunk/data/regressionfiles.txt

[<ate...@us...>]

Revision: 647
          http://svn.sourceforge.net/cclib/?rev=647&view=rev
Author:   atenderholt
Date:     2007-06-12 14:45:18 -0700 (Tue, 12 Jun 2007)

Log Message:
-----------
Regression files: Added the test_Cu2 and test_H2 regression files for Gaussian

Modified Paths:
--------------
    trunk/data/regressionfiles.txt


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[cclib-svn] SF.net SVN: cclib: [685] trunk/data/regressionfiles.txt

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

Revision: 685
          http://svn.sourceforge.net/cclib/?rev=685&view=rev
Author:   langner
Date:     2007-07-11 03:13:19 -0700 (Wed, 11 Jul 2007)

Log Message:
-----------
Added extended water_mp2_nprint9 regression to GAMESS-US (has more data after eigenvectors).

Modified Paths:
--------------
    trunk/data/regressionfiles.txt


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[cclib-svn] SF.net SVN: cclib: [706] trunk/data/regressionfiles.txt

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

Revision: 706
          http://cclib.svn.sourceforge.net/cclib/?rev=706&view=rev
Author:   baoilleach
Date:     2007-08-02 09:03:18 -0700 (Thu, 02 Aug 2007)

Log Message:
-----------
Added Gaussian regression test file supplied by Christoph Steinbeck.

Modified Paths:
--------------
    trunk/data/regressionfiles.txt


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[cclib-svn] SF.net SVN: cclib: [813] trunk/data/regressionfiles.txt

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

Revision: 813
          http://cclib.svn.sourceforge.net/cclib/?rev=813&view=rev
Author:   langner
Date:     2008-05-23 10:21:14 -0700 (Fri, 23 May 2008)

Log Message:
-----------
Removing regression ptnh3_2_H2O_2_2plus (Jaguar 7.0) per request of author.

Modified Paths:
--------------
    trunk/data/regressionfiles.txt


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