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All releases of cclib

  •  09 Jul 2008 12:52
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    Release Notes: cclib can now parse ORCA files. The option to use setuptools instead of distutils.core for installing was added. Handling of CI and TD-DFT data was improved: TD-DFT data extracted from GAMESS and etsecs was standardized across all parsers. The test suite was changed to include output from only the newest program versions. A small number of parsing errors were fixed.

    •  22 Mar 2007 01:19
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      Release Notes: A Jaguar parser has been added. cclib now extracts the Gaussian basis, MP-corrected energies, and the Cartesian displacement vectors of vibrations.

      •  27 Oct 2006 12:27
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        Release Notes: This release fixes various bugs related to the ADF and Gaussian parsers.

        •  05 Oct 2006 10:58
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          Release Notes: A parser for GAMESS-UK is now included. Bugs in several parsers were fixed. guesstype was renamed to ccopen.

          •  19 Jul 2006 17:42
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            Release Notes: Some improvements to ccget. The GAMESS, ADF, and Gaussian parsers were updated to handle more log files.

            •  14 Jun 2006 14:18
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              Release Notes:

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