Subject: MOPAC help

From: Deepak Singh <[email-masked]>
Date: Tue, 23 Feb 1999 11:52:49 -0500

I am using mopac97 to minimize the geometry of a structure and I often
get the following error message

"THE LINE MINIMIZATION FAILED TWICE IN A ROW.   TAKE CARE!"

Does anyone know what it exactly means...My output telle me that SCF was
achieved, but this error is almost always there.

Deepak.

--
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Deepak Singh                        Tel : (315)443 1739 (w)
Graduate Student                          (315)472 9659 (h)
Dept. of Chemistry & Biochemistry   Fax : (315)443 4070
Syracuse University               email : [email-masked]
1-014 CST, Syracuse                 URL : http://web.syr.edu/~desingh
NY 13244

"Violence is the last refuge of the incompetent." --- Salvor Hardin
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