CCL:G: Optimization at MP4 level of the theory
- From: "Syed Tarique Moin"
<tarisyed,,yahoo.com>
- Subject: CCL:G: Optimization at MP4 level of the theory
- Date: Thu, 16 Apr 2009 09:43:58 -0400
Sent to CCL by: "Syed Tarique Moin" [tarisyed,yahoo.com]
Dear CCl users,
I m optimizing the carbon, hydrogen and oxygen containing cluster compounds.
at the MP4 level of the theory using DZP basis set.
I m getting the following error.
Keywords
#OPT MP4(SDTQ) SCF=MaxCycle=9999
NEF-NEF-NEF-NEF-NEF-NEF-NEF-NEF-NEF-NEF-NEF-NEF-NEF-NEF-NEF-NEF-NEF-NEF-
NUMERICAL EIGENVECTOR FOLLOWING MINIMUM SEARCH
INITIALIZATION PASS
************************************************
** ERROR IN INITNF. NUMBER OF VARIABLES ( 0) **
** INCORRECT (SHOULD BE BETWEEN 1 AND 50) **
************************************************
Error termination via Lnk1e in /usr/local/g03/l114.exe at Thu Apr 16 14:48:14
2009.
Job cpu time: 0 days 0 hours 0 minutes 3.5 seconds.
File lengths (MBytes): RWF= 7 Int= 0 D2E= 0 Chk= 1 Scr=
1
Regards