From: Noel O'B. <bao...@gm...> - 2010-03-07 18:40:49
|
Hello everyone, cclib 1.0 is now available for download from http://cclib.sf.net. It's been some time since the last release, so we recommend you to upgrade to this version. Changes since cclib-0.9: Features: * Handle PBC calculations from Gaussian * Updates to handle Gaussian09 * Support TDDFT calculations from ADF * A number of improvements for GAMESS support * ccopen now supports any file-like object with a read() method, so it can parse across HTTP Bugfixes: * Many many additional files parsed thanks to bugs reported by users Remember to cite cclib if you use it to obtain results for publication. This encourages us to keep doing what we do. Regards, The cclib development team |