Subject: one question

From: "zhangxd" <[email-masked]>
Date: Mon, 21 Sep 1998 21:38:01 +0800

hi, Dear netters:
when I run gs94, there is one question as followings.

   709 basis functions     2127 primitive gaussians
   437 alpha electrons      436 beta electrons
       nuclear repulsion energy     29939.3458312225 Hartrees.
 One-electron integrals computed using PRISM.
 The smallest eigenvalue of the overlap matrix is  1.567E-01
 CNDO Guess failed.  Using Huckel.
 DenBas #5 allocation failure:  iend,mxcore=   3042519   2859064
 Error termination via Lnk1e in e:\gs94\l401.exe.
 Job cpu time:  0 days  3 hours 25 minutes 17.0 seconds.
 File lengths (MBytes):  RWF=   35 Int=    0 D2E=    0 Chk=    1 Scr=    1

Could you tell me what happened? Thax in advance.

With best regards,

Zhang, Xiao dong