From: <ate...@us...> - 2006-09-25 22:23:37
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Revision: 347 http://svn.sourceforge.net/cclib/?rev=347&view=rev Author: atenderholt Date: 2006-09-25 15:23:32 -0700 (Mon, 25 Sep 2006) Log Message: ----------- Overlap population analysis (Improvement): Rewrote OPA code so that molecular orbitals aren't iterated over since Numeric has methods to add whole arrays at once; lead to MAJOR speed improvemnt, possibly on the order of 100 times. Modified Paths: -------------- trunk/src/cclib/method/opa.py This was sent by the SourceForge.net collaborative development platform, the world's largest Open Source development site. |