[CHM 331] Correction....
Andrew J. Pounds
pounds_aj at mercer.edu
Sat Feb 4 10:01:30 EST 2017
If you haven't figured it out yet, I made a error when I wrote the 1D
PIB basis functions on the board yesterday. I wrote
$\phi_1(l,x)=\sqrt{\frac{l}{2}} \sin\left(\frac{\pi x}{l}\right)$
when it should have been...
$\phi_1(l,x)=\sqrt{\frac{2}{l}} \sin\left(\frac{\pi x}{l}\right)$
That's what I get for not looking at my notes. Anyway, it should be an
easy fix in your Mathematica notebooks. The value of $c^2$ for $\phi_1$
should be 0.998555
--
Andrew J. Pounds, Ph.D. (pounds_aj at mercer.edu)
Professor of Chemistry and Computer Science
Mercer University, Macon, GA 31207 (478) 301-5627
http://faculty.mercer.edu/pounds_aj
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