The overlap integral for Ï g and Ï u as defined in Section 23.3 is given by

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The overlap integral for ψgand ψuas defined in Section 23.3 is given by

Sab = e 5R/a|1+ 5 R 3 ao 2.

Plot Sab as a function of R/a0 for ζ = 0.8, 1.0, and 1.2. Estimate the value of R/a0 for which Sab = 0.4 for each of these values of ζ.

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Physical Chemistry

ISBN: 978-0321812001

3rd edition

Authors: Thomas Engel, Philip Reid

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