From: <bao...@us...> - 2006-10-31 09:35:15
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Revision: 400 http://svn.sourceforge.net/cclib/?rev=400&view=rev Author: baoilleach Date: 2006-10-31 01:34:14 -0800 (Tue, 31 Oct 2006) Log Message: ----------- Bug Fix: Dermot Brougham emailed me a single point Gaussian calculation where the input coordinates are described by a z-matrix...it didn't parse. This needs some more work to verify that z-matrix optimizations parse correctly. I also need to recreate the bug using a smaller log file. Modified Paths: -------------- trunk/src/cclib/parser/gaussianparser.py This was sent by the SourceForge.net collaborative development platform, the world's largest Open Source development site. |