From: Noel O'B. <bao...@gm...> - 2006-10-26 15:18:12
|
cclib 0.6 has been tagged and uploaded. I've included that final bugfix of yours relating to the SCF convergence. I got very confused this morning as I didn't update my local tree, and ended up fixing the same bug as you did, only to realise that it had already been done. :-P Anyway, I'll do the publicity tomorrow (cclib mailing lists, freshmeat, pypi, gamess-uk forum, possibly CCL), but feel free to update the download links on the wiki - it should be on all of the sourceforge mirrors now. Will this be the version that sets the computational chemistry world alight? We'll soon find out...:-) Noel |