BioPHYSICAL chemistry

(singke) #1
There are a total of four terms in the equation. Two are multiplying x^2 (the
terms in the left-hand parentheses) and can be rewritten by substituting
the value of αfrom eqn 11.9:

(11.21)

So these two terms cancel and we are left with the terms in the right-hand
parentheses:

(11.22)

The product of the wavefunction and the terms in the parentheses must
always zero for all values of the wavefunction, including all non-zero
values. This can only be true if the term in the parentheses is always zero.
Thus, we can write:

(11.23)

Thus, substitution of the wavefunction ψ 0 (x) yields a specific energy of

. This is the ground-state energy. Substitution of the 9 th wavefunction


will yield the energy:

(11.24)

In summary, for the simple harmonic oscillator, the energies of
the wavefunctions are proportional to the quantum number
and separated by a constant factor of Zω(Figure 11.4).

Forbidden region


Classically, the mass attached to the spring vibrates back and
forth and is restricted to a narrow region. The maximum dis-
placement of the mass from the equilibrium position, xTP, is where
the total energy is all potentialenergy, so:

(11.25)

E

kA
A

E

k

==

2
2

2

so

E 9 =+9Z



⎜⎜



⎟⎟

1

2

ω


2

E

mm

mk k

(^0) m
2
2
2
2
12
22 2
/




⎜⎜



⎟⎟ =




ZZ

Z

Z

α ⎜⎜



⎟⎟ =

12

2

/

ψ

(^0) α
2
()x 2 m 2 E 0 0


Z




⎜⎜



⎟⎟=

−+=−



⎜⎜



⎟⎟+=

ZZ

Z

2
4

2
222 m^220

k
m

mk k
α

228 PART 2 QUANTUM MECHANICS AND SPECTROSCOPY


0

4

3

2

1

0

Displacement, x

Potential
energy, V

Energy

Figure 11.4
Energy levels of the
harmonic oscillator
are evenly spaced.

Free download pdf