load "xxx.log" 0
"0" here means "last data set"
On Fri, Nov 1, 2013 at 3:35 PM, lochana menikarachchi <locha...@yahoo.com>wrote:
> Hi Everyone,
>
> How do you read the last coordinates set and charges from a gaussian log
> file. Can somebody provide a code example? I have Jmol.jar in the class
> path. I am not looking for visualization options. I just need to read the
> data into my java program. Should I be using Jmol.jar or JmolLib.jar? If
> somebody can point me to the starting point, I can figure the rest out.
> E.g. How to parse the gaussian log file and how to read the coordinate sets
> etc. I couldn't figure it out by going through source code.
> Thanks.
>
> Lochana
>
>
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--
Robert M. Hanson
Larson-Anderson Professor of Chemistry
St. Olaf College
Northfield, MN
http://www.stolaf.edu/people/hansonr
If nature does not answer first what we want,
it is better to take what answer we get.
-- Josiah Willard Gibbs, Lecture XXX, Monday, February 5, 1900
------------------------------------------------------------------------------
Android is increasing in popularity, but the open development platform that
developers love is also attractive to malware creators. Download this white
paper to learn more about secure code signing practices that can help keep
Android apps secure.
http://pubads.g.doubleclick.net/gampad/clk?id=65839951&iu=/4140/ostg.clktrk
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