CCL:G: Error termination request processed by link 9999
- From: "saif ullah" <sullah : ruc.dk>
- Subject: CCL:G: Error termination request processed by link
9999
- Date: Sun, 13 Jan 2008 14:46:47 -0500
Sent to CCL by: "saif ullah" [sullah,,ruc.dk]
Dear CCLers,
I am facing a problem in geometry optimization (#BPW91/6-31G(d)
OPT=Z-MATRIX) of CH3N+H3 -OOCCH3 molecule with this error,
Optimization stopped.
-- Number of steps exceeded, NStep= 37
-- Flag reset to prevent archiving.
Error termination request processed by link 9999.
Error termination via Lnk1e in /net/node0/g03/l9999.exe at Fri Jan 4 18:25:17
2008.
Job cpu time: 0 days 1 hours 32 minutes 57.0 seconds.
File lengths (MBytes): RWF= 16 Int= 0 D2E= 0 Chk= 7 Scr=
1
I have also tried the keyword opt(MaxCyc=N) but ended with the same error and
don't know how could I overcome this problem.
Any suggestion or comments in this regard would highly be appreciated.
Thanks in advance,
Saif