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<p>One thing you will want to try before you really dive into your
own models is use the potential well depth and width specified in
the project document and see if you can reproduce the results
found in the table on page 5.<br>
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<div class="moz-signature">-- <br>
<b><em>Andrew J. Pounds, Ph.D.</em></b><br>
<em>Professor of Chemistry and Computer Science</em><br>
<em>Director of the Computational Science Program</em><br>
<em>Mercer University</em><br>
<em>1501 Mercer University Drive, Macon, GA 31207 </em><br>
<em>(478) 301-5627</em><br>
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