CCL:G: ERROR in running gaussian
- From: "neeraj misra" <misraneeraj++gmail.com>
- Subject: CCL:G: ERROR in running gaussian
- Date: Thu, 8 Feb 2007 15:33:45 -0800
Sent to CCL by: "neeraj misra" [misraneeraj(0)gmail.com]
I AM REPEATEDLY GETTING AN ERROR FOR THE FOLLOWING STRUCTURE WHOSE INPUT
FILE I AM SENDING AS AN ATTACHMENT.THE GAUSSIAN PROCESSING SIMPLY CANNOT
PROCEDD AFTER A FEW SECONDS.PLEASE HELP ME IN LOCATING THE ERROR.
The Gaussian input file can be looked at:
http://www.ccl.net/temp/TAN2OPTAMP1-inp.txt
while the PDB file at:
http://www.ccl.net/temp/TAN2-PDB.txt
--
neeraj misra
ab initio research lab
department of physics
lucknow university 226006
india