The Chemical Bond
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Extra exercise 1: Properties of the solutions of the Schrödinger equation for a particle in a box

The solution of the Schrödinger equation for the particle in a box with walls at x = 0 and x = p are given by

yn(x) = cnsin(nx), with n = 1,2,3,...,
and cn a coefficient that takes care of the normalization.

a) Show that the wavefunctions yn are normalized if cn = Ö{2/p}.

b) Show that the wavefunctions yn are orthogonal. (Two wavefunctions are called orthogonal if the integral of their product equals zero. So here you have to show that

ó
õ
p

0 
dx yn(x)ym(x) = 0
if n and m differ. Orthogonality is not something specific for a particle in a box. Different solutions of a Schrödinger equation are always orthogonal.)

To simplify the calculation of integrals of trigonometric functions it often helps to write these functions in terms of complex exponentials. For example,

ó
õ
b

a 
dxcos2(x)
    = ó
õ
b

a 
dx é
ê
ë
1
2
(eix+e-ix) ù
ú
û
2

 
    = 1
4
ó
õ
b

a 
dx[ei2x+e-i2x+2]
    = 1
4
é
ê
ë
1
2i
(ei2b-ei2a) - 1
2i
(e-i2b-e-i2a) +2(b-a) ù
ú
û
    = 1
4
é
ê
ë
1
2i
(ei2b-e-i2b) - 1
2i
(ei2a-e-i2a) +2(b-a) ù
ú
û
    = 1
4
[sin2b-sin2a]+ 1
2
(b-a)

Last updated: Saturday, April 06, 2002
© Dr. A.P.J. Jansen