Subject: Re: large 2-electron files

From: [email-masked] (Steven Bachrach)
Date: Fri, 30 Sep 94 09:21:16 -0500

Mike Frisch recently commented:

>In fact,
>there really isn't any size of calculation with should be run with
>conventional SCF on an RS/6000.

Is this really true? If one has a small basis set, say less than 100 functions
is the cost of re-evaluating integrals still less than I/O time?

Is the same thing true for other platforms (in particular SGI)?

Thanks,
Steve

Steven Bachrach				
Department of Chemistry
Northern Illinois University
DeKalb, Il 60115			Phone: (815)753-6863
[email-masked]			Fax:   (815)753-4802