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MATHSCOUT User's Guide Michael P. Barnett,
 

Summary: MATHSCOUT User's Guide
Michael P. Barnett,
Meadow Lakes, Hightstown, NJ 08520,
Joseph F. Capitani,
Joined Departments of Chemistry and Biochemistry,
Manhattan College/The College of Mount Saint Vincent,
Riverdale, NY 10471,
May 31, 2007
The software described in this User's Guide supports the extraction of data
from the output of many programs besides the Gaussian package. The meth-
ods that we used to develop, to test and to document this software have po-
tential uses in other applications of mathematica. The accompanying file
msctDevelopment.tar.gz contains the development software and full informa-
tion on how to use it.
In this User's Guide,
1 describes the input commands,
2 describes the scanning commands,
3 describes some further commands that support auxiliary operations,
4 describes the major commands for mechanized documentation.
5 describes the extraction of all the data from the log files of the water

  

Source: Allen, L.C.- Department of Chemistry, Princeton University

 

Collections: Chemistry