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University Quantum Mechanics II · Deriving the Spherical Harmonics · 1.6

Normalising Yₗᵐ, and the Condon–Shortley phase

The polar equation hands you Pₗᵐ(cos θ) e(imφ) with its constant and its sign still open. Here the constant comes from one integration by parts, and the sign from a choice that keeps every ladder coefficient positive. Get the constant wrong and probabilities fail; get the sign wrong and only superpositions do, which is harder to catch.

01

Build the model

Connect the measurement to the mechanism.

Topic 1.5 left each angular solution as Pₗᵐ(cos θ) e(imφ) times an undetermined constant, because a linear equation cannot set the size of its own solutions. Two further conditions fix that constant, and they are of different kinds. Its magnitude is physics: |Yₗᵐ|² dΩ is the probability of finding the particle's direction inside the solid angle dΩ, so ∫|Yₗᵐ|² dΩ must be 1, and after x = cos θ that reduces to a single Legendre integral Nₘ, which one integration by parts, repeated, climbs from N₀ = 2/(2l + 1) to any m with no new integral.

Its phase is not physics at all: every e(iα) normalises equally well, and no measurement on a single state can see it. The Condon–Shortley choice, (−1)ᵐ for positive m and nothing otherwise, makes every ⟨l, m ± 1|L±|l, m⟩ real and positive, which Quantum Mechanics I assumed when it wrote the ladder coefficients down. Positivity fixes only the signs relative to Yₗ⁰, whose own sign is set by keeping it positive on the +z axis, and Yₗ⁻ᵐ = (−1)ᵐ[Yₗᵐ]* then follows.

The construction is exact for every l and contains no constant of nature, so there is no order in α to check and no approximation to break: the Yₗᵐ are the same for hydrogen, a nucleus or a rigid rotor. Where it fails is in bookkeeping. A convention is a relation among many functions, so it holds only if every table, library routine and Clebsch–Gordan coefficient in a calculation shares it; mix two and the error surfaces in the signs of superpositions, never in a single probability.

Simple definition
Normalising Yₗᵐ means fixing the constant in front of Pₗᵐ(cos θ) e(imφ) so that ∫|Yₗᵐ|² dΩ = 1 over the sphere; the Condon–Shortley phase is the further sign, (−1)ᵐ for positive m, that makes the matrix elements of L₊ and L₋ real and positive.
Example
For l = 1, m = 1: P₁¹ = sin θ, its Legendre norm is ∫₋₁¹ (1 − x²) dx = 4/3, and 1/√(2π × 4/3) = √(3/8π) = 0.3455, so Y₁¹ = −0.3455 sin θ e(iφ) sr⁻¹⁄², the minus sign being the Condon–Shortley phase.
Normalisation on the sphere∫|Yₗᵐ(θ, φ)|² dΩ = 1, with dΩ = sin θ dθ dφ

Put x = cos θ: dx = −sin θ dθ absorbs the Jacobian, the φ-integral gives 2π, and all that is left is one Legendre integral over −1 ≤ x ≤ 1.

dΩ in sr, 4π sr in all; |Yₗᵐ|² is a probability per steradian, so Yₗᵐ carries sr⁻¹⁄²

The Legendre norm recursionNₘ₊₁ = (l + m + 1)(l − m) Nₘ, where Nₘ = ∫₋₁¹ [Pₗᵐ(x)]² dx

Derived here by one integration by parts, with no boundary term because (1 − x²)ᵐ⁺¹ vanishes at both poles. At m = l the factor l − m is zero, so the ladder stops.

Integers 0 ≤ m ≤ l; x = cos θ, so Nₘ is dimensionless. It starts from N₀ = 2/(2l + 1), derived in topic 1.3

The norm in closed formNₘ = [2/(2l + 1)] (l + m)!/(l − m)!

The raw Pₗᵐ differ wildly in size, a factor 720 in norm between m = 0 and m = 3 at l = 3, which is why no harmonic can skip its constant.

The recursion multiplied out. For l = 2 it gives 0.4, 2.4 and 9.6 at m = 0, 1, 2; for l = 3, m = 3 it gives 205.7

Normalised harmonic, Condon–Shortley conventionYₗᵐ = (−1)ᵐ √[(2l + 1)(l − m)!/(4π (l + m)!)] Pₗᵐ(cos θ) e(imφ), m ≥ 0

Y₀⁰ = 1/√(4π) = 0.2821 sr⁻¹⁄², and Y₂² = √(15/32π) sin²θ e(2iφ) = 0.3863 sin²θ e(2iφ) sr⁻¹⁄², both as the Quantum Mechanics I table printed them.

Pₗᵐ(x) = (1 − x²)(m/2) dᵐPₗ/dxᵐ carries no sign here; the root equals 1/√(2πNₘ), in sr⁻¹⁄²

Negative mYₗ⁻ᵐ = (−1)ᵐ [Yₗᵐ]*

Conjugating L₊ gives −L₋, so this relation carries the positive L₊ coefficients over to L₋. Writing Yₗ⁻ᵐ = [Yₗᵐ]* instead turns every coefficient on the negative-m side negative.

m ≥ 0 and * is complex conjugation. Written out, Yₗ⁻ᵐ = +√[…] Pₗᵐ(cos θ) e(−imφ), with no sign in front

Why the sign is neededL₊[Pₗᵐ(cos θ) e(imφ)] = −ħ Pₗᵐ⁺¹(cos θ) e(i[m + 1]φ)

Every step up in m costs a minus sign, which the (−1)ᵐ cancels, leaving ⟨l, m + 1|L₊|l, m⟩ = +ħ√[(l − m)(l + m + 1)], as Quantum Mechanics I assumed.

m ≥ 0, unphased Pₗᵐ; L₊ = ħ e(iφ)(∂/∂θ + i cot θ ∂/∂φ), quoted from Quantum Mechanics I; ħ = 1.055 × 10⁻³⁴ J s

01

The sphere's measure leaves one integral in x

Write the angular solution as A Pₗᵐ(cos θ) e(imφ), take m ≥ 0 for now, and ask what fixes |A|. The full state ψ = R(r) Yₗᵐ(θ, φ) normalises as ∫R² r² dr × ∫|Yₗᵐ|² dΩ, and the convention sets each factor to 1 so that radial and angular tables can be printed separately. Over the sphere dΩ = sin θ dθ dφ, where sin θ is the radius of the ring of latitude at polar angle θ on the unit sphere, shrinking to zero at the poles, so a band of angular width dθ has area 2π sin θ dθ. The φ-integral of |e(imφ)|² = 1 gives 2π. Setting x = cos θ, dx = −sin θ dθ swallows the Jacobian and maps θ = 0 → π onto x = 1 → −1, so the condition becomes |A|² × 2π × Nₘ = 1, with Nₘ = ∫₋₁¹ [Pₗᵐ(x)]² dx. Units: dΩ is in steradians and |Y|² is a probability per steradian, so Y carries sr⁻¹⁄²; the uniform distribution has |Y|² = 1/(4π) = 0.0796 sr⁻¹. Leaving out sin θ is the common slip: it weights a thin polar cap as heavily as the broad equator.

02

One integration by parts climbs the norm ladder

Write Pₗᵐ = (1 − x²)(m/2) uₘ with uₘ = dᵐPₗ/dxᵐ, so that uₘ₊₁ = uₘ′. Differentiating Legendre's equation m times by the Leibniz rule gives (1 − x²)uₘ″ − 2(m + 1)x uₘ′ + (l − m)(l + m + 1)uₘ = 0, and multiplying by (1 − x²)ᵐ folds the first two terms into one derivative: d/dx[(1 − x²)ᵐ⁺¹uₘ′] = −(l − m)(l + m + 1)(1 − x²)ᵐuₘ. Now Nₘ₊₁ = ∫₋₁¹ (1 − x²)ᵐ⁺¹(uₘ′)² dx. Integrate by parts once, treating one uₘ′ as the derivative of uₘ: the boundary term (1 − x²)ᵐ⁺¹uₘuₘ′ vanishes at x = ±1, and what remains is (l − m)(l + m + 1)∫(1 − x²)ᵐuₘ² dx = (l − m)(l + m + 1)Nₘ. Climb from N₀ = 2/(2l + 1), derived in topic 1.3: for l = 2 the rungs are 0.4, 2.4 and 9.6. Check the top rung directly: P₂² = 3(1 − x²), and ∫9(1 − x²)² dx = 9 × 16/15 = 9.6. At m = l the factor l − m vanishes, so Nₗ₊₁ = 0: the recursion itself knows that Pₗᵐ is identically zero beyond m = l.

03

Assembling the constant, and the checks it must pass

Multiplying the rungs gives Nₘ = [2/(2l + 1)](l + m)!/(l − m)!, so |A| = 1/√(2πNₘ) = √[(2l + 1)(l − m)!/(4π(l + m)!)], derived. Four checks. Dimensions: the 4π carries the steradians, and |A|² × 2π × Nₘ is a pure number. The limit l = 0: |A| = 1/√(4π) = 0.2821 sr⁻¹⁄², the uniform distribution. The pole: Pₗ(1) = 1, so Yₗ⁰ on the +z axis equals √[(2l + 1)/4π], which is 0.4886 sr⁻¹⁄² for l = 1 and 0.6308 sr⁻¹⁄² for l = 2, values any table must reproduce. A sum: |Y₁⁰|² + |Y₁¹|² + |Y₁⁻¹|² = (3/4π)cos²θ + 2(3/8π)sin²θ = 3/4π = 0.2387 sr⁻¹ at every θ, so a full p shell is spherical; the general sum Σₘ|Yₗᵐ|² = (2l + 1)/4π is derived from the addition theorem in topic 1.9. The constant depends on |m| only, so Yₗᵐ and Yₗ⁻ᵐ share a modulus. What normalisation cannot do is choose a phase: e(iα)A normalises exactly as well as A, for any real α.

04

The sign that keeps the ladder positive

Quantum Mechanics I wrote L₊ = ħ e(iφ)(∂/∂θ + i cot θ ∂/∂φ) and took ⟨l, m + 1|L₊|l, m⟩ = ħ√[(l − m)(l + m + 1)], real and positive. Test that on the unphased functions, m ≥ 0. On sinᵐθ uₘ(cos θ) e(imφ), ∂/∂φ brings down im, so the bracket acts as ∂/∂θ − m cot θ. Differentiating sinᵐθ gives m cos θ sinᵐ⁻¹θ uₘ, which the −m cot θ term cancels exactly; what survives comes from uₘ(cos θ) through dx/dθ = −sin θ, namely −sinᵐ⁺¹θ uₘ′ = −Pₗᵐ⁺¹. So each step up in m costs a minus sign, and with plain constants every coefficient from m ≥ 0 would be −ħ√[(l − m)(l + m + 1)]. The (−1)ᵐ in Yₗᵐ cancels one sign per step. At l = 1: L₊Y₁⁰ = ħ e(iφ) d/dθ[√(3/4π) cos θ] = −ħ√(3/4π) sin θ e(iφ) = √2 ħ Y₁¹. The sign is chosen, not derived: positive ladder coefficients fix only the signs relative to Yₗ⁰, which is kept positive on the +z axis, and no |Yₗᵐ|² feels either choice. Photoelectrons freed from helium's 1s shell by light polarised along z leave in an l = 1, m = 0 wave (quoted from topic 1.8 and Unit 13), so they emerge as |Y₁⁰|² ∝ cos²θ, an asymmetry parameter β = 2; measured values for helium sit close to 2.

05

Negative m, and the convention that lives in Pₗᵐ

For positive m this lesson writes Yₗ⁻ᵐ = √[(2l + 1)(l − m)!/(4π(l + m)!)] Pₗᵐ(cos θ) e(−imφ), with no sign. Conjugating Yₗᵐ gives (−1)ᵐ times that same function, hence Yₗ⁻ᵐ = (−1)ᵐ[Yₗᵐ]*, derived from the definitions. It matters because the complex conjugate of L₊, as a differential operator, is −L₋: conjugating L₊Yₗᵐ = ħ√[(l − m)(l + m + 1)] Yₗᵐ⁺¹ and inserting the relation gives L₋Yₗ⁻ᵐ = ħ√[(l − m)(l + m + 1)] Yₗ⁻ᵐ⁻¹, positive on the negative-m side too. Many texts and numerical libraries instead put the (−1)ᵐ inside the Legendre function, writing Pₗᵐ(x) = (−1)ᵐ(1 − x²)(m/2) dᵐPₗ/dxᵐ, and extend that phased function to negative order by Pₗ⁻ᵐ = (−1)ᵐ[(l − m)!/(l + m)!]Pₗᵐ, after which one formula with no separate sign serves every m. The harmonics that come out are identical; only the bookkeeping has moved. The danger is using both at once. Before trusting a routine, evaluate P₁¹(0.5): it returns +0.866 in this lesson's convention and −0.866 in the other, and a routine of the second kind must not be multiplied by (−1)ᵐ again.

06

Rebuilding the table, and where a wrong sign shows

From P₂ = (3x² − 1)/2 come P₂¹ = 3x√(1 − x²) = 3 sin θ cos θ and P₂² = 3(1 − x²) = 3 sin²θ. The constants are √(5/4π) for m = 0, √(5/24π) for |m| = 1 and √(5/96π) for |m| = 2, so Y₂⁰ = √(5/16π)(3cos²θ − 1) = 0.3154(3cos²θ − 1), Y₂¹ = −√(15/8π) sin θ cos θ e(iφ) = −0.7725 sin θ cos θ e(iφ), Y₂⁻¹ is the same with +0.7725 and e(−iφ), and Y₂(±2) = √(15/32π) sin²θ e(±2iφ) = 0.3863 sin²θ e(±2iφ), all in sr⁻¹⁄². With Y₀⁰, Y₁⁰ and Y₁(±1) from the sections above, that is the nine-entry table Quantum Mechanics I quoted, now derived, signs included. A wrong sign never shows in a |Yₗᵐ|²; it shows in superpositions. The real orbital pₓ is (Y₁⁻¹ − Y₁¹)/√2 = √(3/4π) sin θ cos φ. Run the same recipe on harmonics without the (−1)ᵐ and it returns −i√(3/4π) sin θ sin φ: a py orbital, the pₓ lobes turned through 90° about z.

02

Change one variable at a time

Make the relationship visible.

Interactive model
2
1
1

The default is Y₂¹, where ⟨2, 2|L₊|2, 1⟩ = +2 ħ. Set the switch to 0: the solid curve flips over while the dashed modulus stays, and the coefficient turns to −2 ħ. Back at 1, set m = −1: Y₂⁻¹ shares the modulus of Y₂¹ but not its sign. Then push |m| past l and watch Nₘ fall to zero.

Interactive physics modelSolid: the normalised harmonic Yₗᵐ(θ, 0) = ε cₗₘ Pₗᵐ(cos θ) against θ for l = 2, m = 1, with Pₗᵐ taken at order |m|; dashed: the modulus |Yₗᵐ|, which no convention moves. Condon–Shortley switch = 1: at 1, ε = −1 for odd positive m and every L₊ coefficient is positive; at 0, the coefficients from m ≥ 0 turn negative. For |m| above l the norm Nₘ is zero and the curve lies flat.Yₗᵐ(θ, φ = 0) for l = 2, m = 1solid Y, dashed |Y|ε = −1, cₗₘ = 0.2575Pₗᵐ ≡ 0 unless |m| ≤ l⟨l, m+1|L₊|l, m⟩ = 2.000 ħ0.50−0.5θ0°90°180°

LEGENDRE NORM Nₘ = ∫[Pₗᵐ]² dx2.400

FACTOR cₗₘ = 1/√(2πNₘ)0.2575 sr⁻¹⁄²

SIGN IN FRONT ε-1

⟨l, m+1|L₊|l, m⟩ / ħ2.000

Live interpretationLEGENDRE NORM Nₘ = ∫[Pₗᵐ]² dx: 2.400. FACTOR cₗₘ = 1/√(2πNₘ): 0.2575 sr⁻¹⁄². SIGN IN FRONT ε: −1. ⟨l, m+1|L₊|l, m⟩ / ħ: 2.000

03

Catch the common trap

Explain before calculating.

Using P₂¹(x) = 3x√(1 − x²), the normalising factor √[(2l + 1)(l − |m|)!/(4π (l + |m|)!)] and this lesson's Condon–Shortley convention, which is Y₂⁻¹(θ, φ)?

Choose an answer to test the model.

04

Practice & worked examples

Reason from the model, then test the result.

EasyStarting from P₃(x) = (5x³ − 3x)/2 and N₀ = 2/(2l + 1), use the norm recursion, not the closed form, to find Y₃²(θ, φ) in the Condon–Shortley convention. Then confirm the constant against the closed form and the norm by direct integration.
  1. Build the function: d²P₃/dx² = 15x, so P₃²(x) = (1 − x²) × 15x = 15 sin²θ cos θ.
  2. Climb the ladder with Nₘ₊₁ = (l + m + 1)(l − m)Nₘ at l = 3: N₀ = 2/7 = 0.2857, N₁ = (4)(3)N₀ = 24/7 = 3.429, N₂ = (5)(2)N₁ = 240/7 = 34.29.
  3. Constant: 1/√(2πN₂) = 1/√(480π/7) = √(7/480π) = 0.06813 sr⁻¹⁄². The closed form gives √(7 × 1!/(4π × 5!)) = √(7/480π), the same.
  4. Sign: m = 2 is even, so (−1)² = +1. Then 15 × 0.06813 = 1.022 = √(105/32π).
  5. Direct check of the norm: ∫₋₁¹ 225x²(1 − x²)² dx = 225 × (2/3 − 4/5 + 2/7) = 225 × 16/105 = 34.29, matching N₂.

AnswerY₃² = +√(105/32π) sin²θ cos θ e(2iφ) ≈ 1.022 sin²θ cos θ e(2iφ) sr⁻¹⁄², with N₂ = 240/7 ≈ 34.3.

MediumTake Y₂¹ = −√(15/8π) sin θ cos θ e(iφ) and apply L₊ = ħ e(iφ)(∂/∂θ + i cot θ ∂/∂φ) to it directly. Show that the result is a positive multiple of Y₂², compare the multiple with ħ√[(l − m)(l + m + 1)], and find what a student whose Y₂¹ lacks the Condon–Shortley sign obtains.
  1. ∂/∂φ acting on e(iφ) gives i, so i cot θ ∂/∂φ becomes −cot θ, and the bracket acts on f(θ) = −√(15/8π) sin θ cos θ as f′ − cot θ f.
  2. f′ = −√(15/8π)(cos²θ − sin²θ) and cot θ f = −√(15/8π) cos²θ, so f′ − cot θ f = +√(15/8π) sin²θ.
  3. Hence L₊Y₂¹ = ħ√(15/8π) sin²θ e(2iφ). Since Y₂² = √(15/32π) sin²θ e(2iφ), the ratio is √(32/8) = 2, so L₊Y₂¹ = 2ħ Y₂².
  4. The formula gives ħ√[(2 − 1)(2 + 1 + 1)] = ħ√4 = 2ħ, the same, and positive. In SI units 2ħ = 2 × 1.0546 × 10⁻³⁴ J s = 2.109 × 10⁻³⁴ J s.
  5. Without the sign, the student's Y₂¹ is the negative of ours while Y₂² is unchanged, since m = 2 is even. So L₊ returns −2ħ times the student's Y₂², though every |Y|² agrees with ours.

AnswerL₊Y₂¹ = +2ħ Y₂², with 2ħ = 2.109 × 10⁻³⁴ J s; without the Condon–Shortley sign the coefficient comes out as −2ħ.

HardAn angular state is ψ(θ, φ) = A sin θ cos φ (1 + cos θ). Find A, expand ψ on the Condon–Shortley Yₗᵐ, give the probability of each (l, m) and ⟨L²⟩, and say which of these results would change if the harmonics carried no (−1)ᵐ.
  1. Normalise: the φ-integral of cos²φ over a full turn is π, and x = cos θ turns the θ-integral into ∫₋₁¹ (1 − x²)(1 + x)² dx = 2 − 2/5 = 8/5. So ∫|ψ|² dΩ = (8π/5)A² = 1, and A = √(5/8π) = 0.4460 sr⁻¹⁄².
  2. Write cos φ = (e(iφ) + e(−iφ))/2 and use Y₁(±1) = ∓√(3/8π) sin θ e(±iφ): sin θ cos φ = √(2π/3)(Y₁⁻¹ − Y₁¹). Likewise Y₂(±1) = ∓√(15/8π) sin θ cos θ e(±iφ) gives sin θ cos θ cos φ = √(2π/15)(Y₂⁻¹ − Y₂¹).
  3. Multiply by A: ψ = √(5/12)(Y₁⁻¹ − Y₁¹) + √(1/12)(Y₂⁻¹ − Y₂¹), coefficients of modulus 0.6455 and 0.2887.
  4. Probabilities: 5/12 = 0.417 for each of (1, −1) and (1, 1), and 1/12 = 0.083 for each of (2, −1) and (2, 1); they sum to 1, confirming A, so P(l = 1) = 5/6 and P(l = 2) = 1/6.
  5. ⟨L²⟩ = ħ²[1(2) × 5/6 + 2(3) × 1/6] = (8/3)ħ² = 2.667 × (1.0546 × 10⁻³⁴ J s)² = 2.97 × 10⁻⁶⁸ J² s².
  6. Without the (−1)ᵐ, Y₁¹ and Y₂¹ each change sign, so ψ = √(5/12)(Y₁⁻¹ + Y₁¹) + √(1/12)(Y₂⁻¹ + Y₂¹) in those harmonics. The coefficients' signs change; ψ itself, the four probabilities and ⟨L²⟩ do not.

AnswerA = √(5/8π) = 0.446 sr⁻¹⁄²; ψ = √(5/12)(Y₁⁻¹ − Y₁¹) + √(1/12)(Y₂⁻¹ − Y₂¹); probabilities 0.417, 0.417, 0.083, 0.083; ⟨L²⟩ = (8/3)ħ² = 2.97 × 10⁻⁶⁸ J² s². Only the coefficient signs depend on the convention.

Extra challenging questions

Connect several ideas, explore supplied data, and compare your reasoning with a worked solution.