Subject: SCIPCM Problem in Gaussian

From: "Nicolas Saettel" <[email-masked]>
Date: Fri, 2 Nov 2001 16:34:03 -0500

Hi all,
I am trying to run a SCIPCM calculation with Gaussian98, but I get this
error message:
 
 WARNING!  Serious error in surface integrals.
 It is probable that some of the solute is outside the cavity and/or
parts of the cavity surface cannot be reached from the origin.
 Try more integration points or a different set of  integration origins.
 Surface Problems in SciFoc

Do you know how to set more integration points, or any other fix?
Thanks in advance,

      Nicolas SAETTEL                       http://www.nd.edu/~nsaettel 
   University of Notre Dame                
Department of Chemistry and Biochemistry   
     NOTRE DAME, IN 46556                    tel: +1 (219) 631-4007