From: Karol L. <kar...@gm...> - 2015-05-06 18:52:16
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Hi Jos, Can you provide us with the output file? If you can, we will be more than happy to fix the issue. Cheers, Karol On Wed, May 6, 2015 at 9:45 AM, Jos Teunissen <jlt...@gm...> wrote: > Dear Reader, > > When i want to parse a Gaussian output consisting of multiple steps I get > an AssertionError. Do you have any suggestions? or do i really have to > split the file first? > > Kind regards, > Jos > > The job: > %chk=hclsto.chk > # am1/sto-3g opt > > Title Card Required > > 0 1 > H 0.0 0.0 0.0 > Cl 0.0 0.0 1.1 > > --link1-- > %chk=hclsto.chk > # geom=check mp2/6-31G > > plus > > 1 2 > > > > > ------------------------------------------------------------------------------ > One dashboard for servers and applications across Physical-Virtual-Cloud > Widest out-of-the-box monitoring support with 50+ applications > Performance metrics, stats and reports that give you Actionable Insights > Deep dive visibility with transaction tracing using APM Insight. > http://ad.doubleclick.net/ddm/clk/290420510;117567292;y > _______________________________________________ > cclib-users mailing list > ccl...@li... > https://lists.sourceforge.net/lists/listinfo/cclib-users > > |