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HARMONIC OSCILLATOR IN 3-D: SPHERICAL

COORDINATES

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Reference: Griffiths, David J. (2005), Introduction to Quantum Mechan-
ics, 2nd Edition; Pearson Education - Problem 4.39.
The 3-d harmonic oscillator can also be solved in spherical coordinates.
Since the potential is a function of r only, the angular part of the solution is
a spherical harmonic.
To solve the radial equation we substitute the potential V (r) = 12 mω 2 r2 .

h̄2 d 2 u h̄2 l(l + 1)


 
1 2 2
− + mω r + u = Eu (1)
2m dr2 2 2m r2
Using the treatment of the hydrogen atom as a guide we can proceed as
follows. First, define κ 2 = 2mE/h̄2 (note that E is positive for all states,
and κ has dimensions of length−1 ) and divide through to get

1 d2u l(l + 1) m2 ω 2
 
2
− + 2 (κr) u = −u (2)
κ 2 dr2 (κr)2 h̄ κ 4
We now define

ρ ≡ κr (3)

ρ0 ≡ (4)
h̄κ 2
Note that both ρ and ρ0 are dimensionless. With these definitions, we get

d2u
 
l(l + 1) 2 2
= −1 + + ρ0 ρ u (5)
dρ 2 ρ2
Now we need to investigate the behaviour of u for ρ → ∞ and ρ → 0.
From ??, as ρ → ∞, the ρ 2 term dominates and the equation becomes

d2u
2
≈ ρ02 ρ 2 u (6)

We can get the solution to this approximate equation
2 /2 2 /2
u ≈ Ae−ρ0 ρ + Beρ0 ρ (7)
1
HARMONIC OSCILLATOR IN 3-D: SPHERICAL COORDINATES 2

for some constants A and B. The second term is not normalizable, so we


take B = 0.
This works as an approximate solution because

du 2
= −ρ0 ρAe−ρ0 ρ /2 (8)

d2u −ρ0 ρ 2 /2 2 2

= Ae −ρ 0 + ρ 0 ρ (9)
dρ 2

2 /2
For large ρ, the last term is approximately Aρ02 ρ 2 e−ρ0 ρ = ρ02 ρ 2 u.
For ρ → 0, the ρ −2 term dominates and we get

d 2 u l(l + 1)
≈ u (10)
dρ 2 ρ2

which has the normalizable solution

u ≈ Cρ l+1 + Dρ −l (11)

for some constants C and D. Again, we can set D = 0 to prevent the solution
from becoming infinite at ρ = 0.
We therefore propose that the exact solution will have the form

2 /2
u(ρ) = ρ l+1 e−ρ0 ρ v(ρ) (12)

for some function v(ρ).


To proceed, we must substitute ?? into ??, so we need to calculate d 2 u/dρ 2
in terms of v(ρ) and its derivatives.
HARMONIC OSCILLATOR IN 3-D: SPHERICAL COORDINATES 3

du 2 2 2 dv
= (l + 1)ρ l e−ρ0 ρ /2 v(ρ) − ρ0 ρ l+2 e−ρ0 ρ /2 v(ρ) + ρ l+1 e−ρ0 ρ /2
dρ dρ
(13)
 
2 dv
= ρ l e−ρ0 ρ /2 v(l + 1 − ρ0 ρ 2 ) + ρ (14)

d2u
 
l−1 −ρ0 ρ 2 /2 2 dv
= lρ e v(l + 1 − ρ0 ρ ) + ρ − (15)
dρ 2 dρ
 
l+1 −ρ0 ρ 2 /2 2 dv
ρ0 ρ e v(l + 1 − ρ0 ρ ) + ρ (16)

d2v
 
l −ρ0 ρ 2 /2 2 dv
+ρ e (−2ρ0 ρ)v + (l + 2 − ρ0 ρ ) +ρ 2 (17)
dρ dρ
We can now substitute the second derivative and ?? into ?? and collect
terms.
 
2 2 dv
(l − ρ0 ρ ) v(l + 1 − ρ0 ρ ) + ρ + (18)

d2v
   
2 dv l(l + 1)
ρ (−2ρ0 ρ)v + (l + 2 − ρ0 ρ ) + ρ 2 = −1 + + ρ0 ρ ρ 2 v
2 2
dρ dρ ρ2
(19)
d2v dv
ρ2 2
+ 2((l + 1)ρ − ρ0 ρ 3 ) + ρ 2 (1 − ρ0 (2l + 3))v = 0 (20)
dρ dρ
d2v  dv
ρ 2 + 2 l + 1 − ρ0 ρ 2 + ρ(1 − ρ0 (2l + 3))v = 0 (21)
dρ dρ
We can now seek a solution where v(ρ) = ∑ c j ρ j as was done for the
hydrogen atom. Substituting the series gives

∑ c j j( j − 1)ρ j−1 + 2(l + 1) ∑ c j jρ j−1 − 2ρ0 ∑ c j jρ j+1 + (1 − ρ0(2l + 3)) ∑ c j ρ j+1 = 0


(22)
We need to equate the coefficient of each power of ρ to zero separately,
so we can redefine the index of summation in each case to make all the
exponents of ρ the same:

∑ c j+1( j +1) jρ j +2(l +1) ∑ c j+1( j +1)ρ j −2ρ0 ∑ c j−1( j −1)ρ j +(1−ρ0(2l +3)) ∑ c j−1ρ j = 0
(23)
Consider first the term with j = 0. This gives:
HARMONIC OSCILLATOR IN 3-D: SPHERICAL COORDINATES 4

2(l + 1)c1 + (2ρ0 + 1 − ρ0 (2l + 3))c−1 = 0 (24)

Since the series starts with the j = 0 term, c−1 = 0, so we must have c1 = 0
as well.
Considering the general case gives the recurrence relation:

ρ0 (2 j + 2l + 1) − 1
c j+1 = c j−1 (25)
( j + 1)( j + 2(l + 1))
Since we know that c1 = 0 this relation tells us that all odd powers in the
series must be zero: c2k+1 = 0 for all k = 0, 1, 2, . . ..
We can alter the recursion relation slightly to make it look more natural
by defining a new index variable q ≡ j − 1. Substituting this into ?? gives

ρ0 (2q + 2l + 3) − 1
cq+2 = cq (26)
(q + 2)(q + 2l + 3)
where q = 0, 2, 4, 6, . . .. The coefficient c0 must of course be determined by
normalization, which we won’t bother with here.
For large q this has the asymptotic behaviour:
2ρ0
cq+2 ≈ cq (27)
q+2
This is the same sort of asymptotic behaviour considered in the derivation
of the radial function for the hydrogen atom, so if the series was infinite, it
would lead to an exponential that blows up at infinite values of ρ. Thus we
must require the series to terminate at some point, so from ?? we must have
for some qmax :
1
ρ0 = (28)
2qmax + 2l + 3
If we recall the original definitions of ρ0 and κ this translates into a con-
dition on the energy:
 
3
E = h̄ω qmax + l + (29)
2
This is valid for all non-negative values of l but only for even qmax , so we
can make the formula a bit more explicit by introducing a new parameter k
such that qmax = 2k and k = 0, 1, 2, 3, . . .. thus we have
 
3
E = h̄ω 2k + l + (30)
2
HARMONIC OSCILLATOR IN 3-D: SPHERICAL COORDINATES 5

If we define a final quantum number n ≡ 2k + l we get the well-known


formula for the energies of the 3-d harmonic oscillator:
 
3
En = h̄ω n + (31)
2
Finally, we should check that the degeneracies of En match those for the
solution where we solved the system in rectangular coordinates. To do this,
we need to calculate how many ways each level n can be formed.
We know that n = 2k +l, and also that the number l relates to the spherical
harmonic that is the solution of the angular part of the Schrödinger equation.
For each value of l there are 2l +1 spherical harmonics with different values
of m. So we need to figure out first, how many combinations of k and l can
add up to n = 2k + l and, second, how many states in total does this amount
to when we take into consideration the 2l + 1 states for each value of l?
It is easiest to consider these questions for even and odd values of n sepa-
rately. First, consider the case of n odd. In that case, k = 0, 1, 2, . . . (n − 1)/2
and l = 1, 3, 5, . . . n are the possible values of k and l. For example, we could
have l = 1; k = (n − 1)/2 or l = 3; k = (n − 1)/2 − 1 and so on. Thus we
can write that l = 2a + 1 where a = 0, 1, 2, . . . (n − 1)/2. Since each value
of l has a degeneracy of 2l + 1 the total degeneracy of level n is:

(n−1)/2
d(n) = ∑ (2(2a + 1) + 1) (32)
a=0
   
1 (n − 1) (n + 1) n−1
= 4 +3 +1 (33)
2 2 2 2
1
= (n + 1)(n + 2) (34)
2

which agrees with the value of d(n) from our previous solution.
For even n the ranges are k = 0, 1, 2, . . . n/2 and l = 0, 2, 4, . . . n so we can
write l = 2a for a = 0, 1, 2, 3, . . . n/2. The degeneracy in this case is

n/2
d(n) = ∑ (2(2a) + 1) (35)
a=0
1 n n  n
= 4 +1 + +1 (36)
22 2 2
1
= (n + 1)(n + 2) (37)
2

which again agrees with the earlier solution.


HARMONIC OSCILLATOR IN 3-D: SPHERICAL COORDINATES 6

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