From: Adam T. <a-t...@st...> - 2006-10-05 17:29:44
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Nice talk. So we're going to implement CDA and AIM at some point?!? How exciting! I've actually started looking at implementing Lowdin population analysis since it looks like it's basically a few matrix multiplications, inversions, and some addition...although I don't completely understand the advantages it has over Mulliken. Adam On Oct 5, 2006, at 8:57 AM, Noel O'Boyle wrote: > I recently presented cclib 0.5 at CompLife '06 at the Uni of > Cambridge, U.K. (where I am based). For some nice pictures along > with a brief discussion, please see http://cclib.sourceforge.net/ > wiki/index.php/Complife06. (I will put a link to this from the main > cclib page eventually) > > Regards, > Noel > ---------------------------------------------------------------------- > --- > Take Surveys. Earn Cash. Influence the Future of IT > Join SourceForge.net's Techsay panel and you'll get the chance to > share your > opinions on IT & business topics through brief surveys -- and earn > cash > http://www.techsay.com/default.php? > page=join.php&p=sourceforge&CID=DEVDEV________________________________ > _______________ > cclib-devel mailing list > ccl...@li... > https://lists.sourceforge.net/lists/listinfo/cclib-devel |