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Multipole Operators

Multipole operators organize how a localized quantum system couples to long-wavelength electromagnetic probes. For selection rules, the most important facts are not the detailed normalization constants but the transformation labels:

  • rotational rank λ\lambda;
  • spherical component q=−λ,…,λq=-\lambda,\ldots,\lambda;
  • parity, even or odd under spatial inversion.

An electric multipole of order λ\lambda is denoted EλE\lambda. A magnetic multipole of order λ\lambda is denoted MλM\lambda. The familiar examples are electric dipole E1E1, magnetic dipole M1M1, and electric quadrupole E2E2.

This page classifies multipole operators by symmetry. Atomic Selection Rules applies E1E1, M1M1, and E2E2 rules to electronic and hyperfine levels, polarization, metastability, and state mixing. Transition rates, oscillator strengths, line shapes, and detailed spectroscopy require dynamical matrix elements and belong to transition-theory and spectroscopy pages.

The standard symmetry labels are:

OperatorRotational rankParity
EλE\lambdaλ\lambda(−1)λ(-1)^\lambda
MλM\lambdaλ\lambda(−1)λ+1(-1)^{\lambda+1}

Thus:

MultipoleRankParityUsual name
E0E000evenelectric monopole
E1E111oddelectric dipole
M1M111evenmagnetic dipole
E2E222evenelectric quadrupole
M2M222oddmagnetic quadrupole
E3E333oddelectric octupole

The rank controls angular-momentum selection rules. The parity controls whether the operator connects states of the same or opposite parity.

For point charges in a fixed origin convention, the electric multipole operator can be written schematically as

Qq(λ)=∑aearaλCq(λ)(r^a),q=−λ,…,λ,Q_q^{(\lambda)} = \sum_a e_a r_a^\lambda C_q^{(\lambda)}(\hat{\mathbf r}_a), \qquad q=-\lambda,\ldots,\lambda,

where Cq(λ)C_q^{(\lambda)} is a normalized spherical harmonic:

Cq(λ)(r^)=4π2λ+1 Yλq(r^).C_q^{(\lambda)}(\hat{\mathbf r}) = \sqrt{\frac{4\pi}{2\lambda+1}}\, Y_\lambda^q(\hat{\mathbf r}).

The exact normalization differs across atomic, molecular, nuclear, and radiation conventions. The symmetry content is stable: Qq(λ)Q_q^{(\lambda)} is an irreducible spherical tensor of rank λ\lambda.

Under parity,

r↦−r,Yλq(−r^)=(−1)λYλq(r^),\mathbf r\mapsto-\mathbf r, \qquad Y_\lambda^q(-\hat{\mathbf r}) = (-1)^\lambda Y_\lambda^q(\hat{\mathbf r}),

so

ΠQq(λ)Π−1=(−1)λQq(λ).\Pi Q_q^{(\lambda)}\Pi^{-1} = (-1)^\lambda Q_q^{(\lambda)}.

That is the parity rule for EλE\lambda.

The electric dipole moment is

d=∑aeara.\mathbf d = \sum_a e_a\mathbf r_a.

It is a rank-11 polar vector and is parity odd:

ΠdΠ−1=−d.\Pi\mathbf d\Pi^{-1} = -\mathbf d.

In spherical components,

d0=dz,d±1=∓12(dx±idy).d_0=d_z, \qquad d_{\pm1} = \mp\frac{1}{\sqrt2}(d_x\pm id_y).

The electric-dipole selection rules are developed in Dipole Transitions. In short, E1E1 transitions obey rank-11 angular rules and require opposite parity.

The electric quadrupole is the rank-22 part of two powers of position. In Cartesian form a common traceless quadrupole tensor is

Qij=∑aea(3ra,ira,j−δijra2).Q_{ij} = \sum_a e_a \left( 3r_{a,i}r_{a,j} - \delta_{ij}r_a^2 \right).

It is symmetric and traceless:

Qij=Qji,∑iQii=0.Q_{ij}=Q_{ji}, \qquad \sum_i Q_{ii}=0.

The five independent components correspond to a rank-22 irreducible spherical tensor Qq(2)Q_q^{(2)} with q=−2,−1,0,1,2q=-2,-1,0,1,2. Since it contains two powers of position, it is parity even:

ΠQq(2)Π−1=Qq(2).\Pi Q_q^{(2)}\Pi^{-1} = Q_q^{(2)}.

Thus electric-quadrupole matrix elements connect states of the same parity, subject to rank-22 angular selection rules.

Magnetic multipoles involve currents, orbital angular momentum, spin, and magnetization rather than only charge density. Their detailed forms depend more strongly on the physical system and approximation.

For symmetry work, the key fact is that magnetic multipoles have parity

ηMλ=(−1)λ+1.\eta_{M\lambda} = (-1)^{\lambda+1}.

The simplest example is the magnetic dipole M1M1. In a nonrelativistic atom-like model, a magnetic moment operator has the schematic form

μ∼μB(L+gsS),\boldsymbol\mu \sim \mu_B \left( \mathbf L+g_s\mathbf S \right),

with model-dependent charge, mass, and gg-factor coefficients. Both L\mathbf L and S\mathbf S are axial vectors, so μ\boldsymbol\mu is parity even:

ΠμΠ−1=μ.\Pi\boldsymbol\mu\Pi^{-1} = \boldsymbol\mu.

Therefore M1M1 transitions connect states of the same parity, subject to rank-11 angular rules.

If a multipole operator is an irreducible tensor of rank λ\lambda, the Wigner–Eckart theorem gives the angular constraints

∣Ji−λ∣≤Jf≤Ji+λ|J_i-\lambda| \le J_f \le J_i+\lambda

and

Mf=Mi+q,q=−λ,…,λ.M_f=M_i+q, \qquad q=-\lambda,\ldots,\lambda.

The triangle rule is necessary, not sufficient. The reduced matrix element may vanish for dynamical reasons or because of additional symmetries.

Some common low-rank consequences are:

MultipoleAngular rank ruleParity rule
E1E1ΔJ=0,±1\Delta J=0,\pm1 subject to triangle constraintsopposite parity
M1M1ΔJ=0,±1\Delta J=0,\pm1 subject to triangle constraintssame parity
E2E2ΔJ=0,±1,±2\Delta J=0,\pm1,\pm2 subject to triangle constraintssame parity
M2M2ΔJ=0,±1,±2\Delta J=0,\pm1,\pm2 subject to triangle constraintsopposite parity

For rank λ>0\lambda>0, a Ji=0J_i=0 to Jf=0J_f=0 matrix element is excluded by the triangle rule. A rank-00 operator can connect J=0J=0 to J=0J=0, but an E0E0 transition is not ordinary single-real-photon emission. That statement involves radiation dynamics, not just operator symmetry.

For central-potential scalar orbital states, parity is

πℓ=(−1)ℓ.\pi_\ell=(-1)^\ell.

An electric multipole EλE\lambda has parity (−1)λ(-1)^\lambda, so it requires

(−1)ℓf−ℓi=(−1)λ.(-1)^{\ell_f-\ell_i} = (-1)^\lambda.

Thus ℓf−ℓi\ell_f-\ell_i has the same even/odd character as λ\lambda.

For E1E1, λ=1\lambda=1, so ℓf−ℓi\ell_f-\ell_i is odd. Combining with the rank-11 triangle rule gives

Δℓ=±1.\Delta\ell=\pm1.

For E2E2, λ=2\lambda=2, so ℓf−ℓi\ell_f-\ell_i is even. Combining with the rank-22 triangle rule gives

Δℓ=0,±2,\Delta\ell=0,\pm2,

where the values are restricted by nonnegative angular momentum and possible vanishing angular coefficients.

Multipoles also appear as an expansion in the size of the system relative to the wavelength of the probe. If aa is a characteristic size and kk is the radiation wavenumber, then the long-wavelength regime has

ka≪1.ka\ll1.

Higher multipoles are often suppressed by additional powers of kaka, which is why E1E1 usually dominates when it is allowed. But “usually smaller” is not a selection rule. If E1E1 is forbidden by parity, angular momentum, spin, or another symmetry, a weaker M1M1, E2E2, two-photon, or symmetry-breaking mechanism may become the leading observed process.

Dipole Approximation owns the controlled field expansion, transition-specific size tests, center-of-mass phase distinction, and consistent expansion of probabilities. Multipole Expansion owns the corresponding AMO coupling hierarchy, mode-geometry effects, free-space rates, and forbidden-transition applications.

Multipole operators are defined relative to an origin. In atomic physics the origin is often the nucleus or center of mass. In molecular and condensed systems one must choose the origin consistently with the symmetry being used.

The parity classification assumes the origin is at the inversion center. If the origin is shifted away from that center, different multipole orders can mix in their Cartesian expansion, and a naive parity argument can be obscured.

Gauge choices and center-of-mass separation also affect detailed operator forms. The rank and parity selection rules are robust only after the physical approximation has been stated.

  • Treating “multipole order” as only a power of rr and forgetting rotational rank.
  • Forgetting that EλE\lambda and MλM\lambda have different parity for the same λ\lambda.
  • Calling an E1E1-forbidden line impossible rather than forbidden at electric-dipole order.
  • Applying parity rules without placing the origin at the inversion center.
  • Assuming a symmetry-allowed multipole matrix element must be large.
  • Mixing Cartesian quadrupole tensors with irreducible rank-22 spherical components without removing the trace.
  • A. R. Edmonds, Angular Momentum in Quantum Mechanics, Princeton University Press, 1957.
  • M. E. Rose, Elementary Theory of Angular Momentum, Wiley, 1957.
  • J. J. Sakurai and J. Napolitano, Modern Quantum Mechanics, 3rd ed., Cambridge University Press, 2020.
  • C. Cohen-Tannoudji, J. Dupont-Roc, and G. Grynberg, Atom-Photon Interactions, Wiley, 1992.
  • I. I. Sobelman, Atomic Spectra and Radiative Transitions, 2nd ed., Springer, 1992.
  • J. D. Jackson, Classical Electrodynamics, 3rd ed., Wiley, 1998.
  1. Fill in the parity of E1E1, M1M1, E2E2, and M2M2.
Solution

Use

ηEλ=(−1)λ,ηMλ=(−1)λ+1.\eta_{E\lambda}=(-1)^\lambda, \qquad \eta_{M\lambda}=(-1)^{\lambda+1}.

Thus

E1: −1,M1: +1,E2: +1,M2: −1.E1:\ -1, \qquad M1:\ +1, \qquad E2:\ +1, \qquad M2:\ -1.
  1. Which of E1E1, M1M1, E2E2, and E0E0 can connect Ji=0J_i=0 to Jf=0J_f=0 by angular momentum alone?
Solution

A rank-λ\lambda operator must satisfy

∣Ji−λ∣≤Jf≤Ji+λ.|J_i-\lambda| \le J_f \le J_i+\lambda.

With Ji=Jf=0J_i=J_f=0, this requires λ=0\lambda=0. Therefore E1E1, M1M1, and E2E2 are excluded by angular momentum, while a rank-00 operator such as E0E0 is not excluded by this angular rule. Whether an E0E0 transition occurs through a particular radiation process is a separate dynamical question.

  1. For scalar orbital states in a central potential, combine parity and rank for an E2E2 operator. What Δℓ\Delta\ell values survive?
Solution

An E2E2 operator has rank 22 and even parity. The rank-22 triangle rule permits

ℓf=ℓi,ℓi±1,ℓi±2\ell_f=\ell_i,\ell_i\pm1,\ell_i\pm2

where valid. Even parity requires ℓf−ℓi\ell_f-\ell_i even. The surviving values are

Δℓ=0,±2,\Delta\ell=0,\pm2,

again subject to nonnegative angular momentum and possible vanishing coefficients in special boundary cases.

  1. Why is a magnetic dipole parity even although it is a vector under rotations?
Solution

A magnetic dipole is an axial vector. In nonrelativistic models it is built from angular momentum operators such as L\mathbf L and S\mathbf S. Since

L=R×P\mathbf L=\mathbf R\times\mathbf P

and both R\mathbf R and P\mathbf P change sign under parity, L\mathbf L is unchanged. Spin is also parity even in the usual nonrelativistic representation. Thus μ\boldsymbol\mu is even under parity even though it has rotational rank 11.