CCL:G: error in qst2 calculations in Gauss



 Sent to CCL by: "Shuping  Huang" [huangshp,fjirsm.ac.cn]
 Dear all,
   I used qst2 to find transition state. The input file is as follows:
 %mem=500mb
 %nproc=4
 #p opt=(qst2,maxcycle=500) freq mp2/6-31g(d) geom=connectivity scf=maxcycle=800
 The job failed. The error message is as follws:
 Iteration100 RMS(Cart)=  0.00007251 RMS(Int)=  0.18458671
  New curvilinear step not converged.
  ***** Convergence failure in GTrans *****
  Try using 3 structures as input for
  QST transition state search
  Error termination via Lnk1e in /usr/local/bin/g03/l101.exe at Tue Apr 28
 22:56:06 2009.
  Job cpu time:  0 days  0 hours  0 minutes  0.6 seconds.
  File lengths (MBytes):  RWF=      8 Int=      0 D2E=      0 Chk=      1 Scr=
 1
 Any suggestio would be highly apriciated.