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Foldy–Wouthuysen Expansion

The Foldy–Wouthuysen expansion turns the Dirac equation into an effective two-component theory with a specified accuracy. For static electromagnetic backgrounds, the first corrections contain the relativistic kinetic energy, spin–orbit coupling, and the Darwin term. Magnetic corrections occur at the same formal order unless an additional field-strength hierarchy suppresses them. This page derives the ordered Hamiltonian; the Foldy–Wouthuysen Transformation owns the representation change and the transformation of observables.

Required background. The Foldy–Wouthuysen Transformation introduces block diagonalization, and Minimal Coupling fixes the electromagnetic conventions. Helpful background. Dirac to Pauli derives the leading two-component limit.

Static Dirac Hamiltonian and expansion scales

Section titled “Static Dirac Hamiltonian and expansion scales”

Take m>0m>0, real time-independent potentials, and the signed charge qq. Write

H=βM+V+O,M=mc2,V=qΦ,O=cα⋅π,π=p−qA.\begin{aligned} H&=\beta M+V+\mathcal O,\qquad M=mc^2,\\ V&=q\Phi,\\ \mathcal O&=c\boldsymbol\alpha\cdot\boldsymbol\pi,\\ \boldsymbol\pi&=\mathbf p-q\mathbf A. \end{aligned}

Here VV is even and O\mathcal O is odd with respect to β\beta. Initially use smooth fields and a common domain on which the displayed products and commutators make sense. The calculation is a low-energy asymptotic expansion, not an operator-norm Taylor series on the full unbounded Dirac Hilbert space.

For the formal counting, hold m,q,ℏ,Φ,Am,q,\hbar,\Phi,\mathbf A and spatial derivatives fixed as cc increases. Then M=O(c2)M=O(c^2), O=O(c)\mathcal O=O(c), and V=O(1)V=O(1). For an actual state, kinetic momenta must be small compared with mcmc, field variation must not resolve arbitrarily short Compton-scale structure, and electric-potential differences sampled by the state must not invalidate the separation of energy sectors. A constant offset of Φ\Phi does not control this approximation: it only changes the energy origin. Strong or singular backgrounds need their own domain and scale analysis.

Removing the odd part with nested commutators

Section titled “Removing the odd part with nested commutators”

Use ψ′=eGψ\psi'=e^G\psi, with the anti-Hermitian generator

G=βO2M.G=\frac{\beta\mathcal O}{2M}.

The Baker–Campbell–Hausdorff series is

eGHe−G=H+[G,H]+12[G,[G,H]]+⋯ .\begin{aligned} e^GHe^{-G} ={}&H+[G,H]\\ &+\frac12[G,[G,H]]+\cdots . \end{aligned}

Because βO=−Oβ\beta\mathcal O=-\mathcal O\beta,

[G,βM]=−O,[G,O]=βO2M.[G,\beta M]=-\mathcal O,\qquad [G,\mathcal O]=\frac{\beta\mathcal O^2}{M}.

The first equation cancels the original odd term. Combining the mass and odd-operator series gives

eG(βM+O)e−G=βM+βO22M−O33M2−βO48M3+⋯ .\begin{aligned} e^G(\beta M+\mathcal O)e^{-G} ={}&\beta M+\frac{\beta\mathcal O^2}{2M} -\frac{\mathcal O^3}{3M^2}\\ &-\frac{\beta\mathcal O^4}{8M^3} +\cdots . \end{aligned}

The potential contributes

eGVe−G=V+β[O,V]2M−[O,[O,V]]8M2+⋯ .\begin{aligned} e^GVe^{-G} ={}&V+\frac{\beta[\mathcal O,V]}{2M}\\ &-\frac{[\mathcal O,[\mathcal O,V]]}{8M^2} +\cdots . \end{aligned}

For example, the sign of the double commutator follows from [βO,β[O,V]]=−[O,[O,V]][\beta\mathcal O,\beta[\mathcal O,V]] =-[\mathcal O,[\mathcal O,V]]. The remaining leading odd operator is

O1=β[O,V]2M−O33M2,O1=O(c−1).\mathcal O_1 =\frac{\beta[\mathcal O,V]}{2M} -\frac{\mathcal O^3}{3M^2}, \qquad \mathcal O_1=O(c^{-1}).

A second transformation with G1=βO1/(2M)G_1=\beta\mathcal O_1/(2M) cancels it. Its new even terms start at O(c−4)O(c^{-4}) in the stated counting; remaining odd terms can be removed iteratively. The even Hamiltonian through O(c−2)O(c^{-2}) is therefore

HFW=βM+V+βO22M−βO48M3−[O,[O,V]]8M2+higher-order terms.\begin{aligned} H_{\rm FW} ={}&\beta M+V +\frac{\beta\mathcal O^2}{2M} \\ &-\frac{\beta\mathcal O^4}{8M^3} -\frac{[\mathcal O,[\mathcal O,V]]}{8M^2}\\ +\text{higher-order terms}. \end{aligned}

This is the static version of the expansion of Foldy and Wouthuysen (1950); Littlejohn’s notes give a useful complementary derivation with atomic power counting. For a time-dependent transformation, the additional iℏ(∂tU)U†i\hbar(\partial_tU)U^\dagger term must also be expanded. Substituting time-dependent fields into this static formula does not perform that calculation.

Magnetic square and the electric commutator

Section titled “Magnetic square and the electric commutator”

The kinetic-momentum algebra gives

O2=c2F,F=π2−qℏΣ⋅B.\mathcal O^2=c^2F,\qquad F=\boldsymbol\pi^2-q\hbar\boldsymbol\Sigma\cdot\mathbf B.

Consequently O4=c4F2\mathcal O^4=c^4F^2 as an ordered operator. In particular,

F2=π4−qℏ{π2,Σ⋅B}+q2ℏ2B2.\begin{aligned} F^2={}&\boldsymbol\pi^4 -q\hbar\{\boldsymbol\pi^2, \boldsymbol\Sigma\cdot\mathbf B\}\\ &+q^2\hbar^2\mathbf B^2. \end{aligned}

The anticommutator retains gradients of an inhomogeneous magnetic field. The last equality uses (Σ⋅B)2=B2(\boldsymbol\Sigma\cdot\mathbf B)^2=\mathbf B^2 for an ordinary classical field. Replacing F2F^2 by π4\boldsymbol\pi^4 would discard terms of the same formal order for fixed nonzero B\mathbf B. Such a replacement needs an additional weak-field counting.

For the electric term, first observe

[α⋅π,V]=−iℏα⋅∇V.[\boldsymbol\alpha\cdot\boldsymbol\pi,V] =-i\hbar\boldsymbol\alpha\cdot\nabla V.

Using αiαj=δij+iϵijkΣk\alpha_i\alpha_j=\delta_{ij} +i\epsilon_{ijk}\Sigma_k and allowing each momentum to differentiate the field yields

[α⋅π,[α⋅π,V]]=−ℏ2∇2V−ℏΣ⋅(∇V×π−π×∇V).\begin{aligned} &[\boldsymbol\alpha\cdot\boldsymbol\pi, [\boldsymbol\alpha\cdot\boldsymbol\pi,V]]\\ &\quad=-\hbar^2\nabla^2V -\hbar\boldsymbol\Sigma\cdot \bigl(\nabla V\times\boldsymbol\pi -\boldsymbol\pi\times\nabla V\bigr). \end{aligned}

Since ∇V=−qE\nabla V=-q\mathbf E for these static potentials, the equivalent field form is

[α⋅π,[α⋅π,qΦ]]=qℏ2∇⋅E+qℏΣ⋅(E×π−π×E).\begin{aligned} &[\boldsymbol\alpha\cdot\boldsymbol\pi, [\boldsymbol\alpha\cdot\boldsymbol\pi,q\Phi]]\\ &\quad=q\hbar^2\nabla\cdot\mathbf E +q\hbar\boldsymbol\Sigma\cdot (\mathbf E\times\boldsymbol\pi -\boldsymbol\pi\times\mathbf E). \end{aligned}

The cross-product difference is explicitly Hermitian. Here ∇×E=0\nabla\times\mathbf E=0, so it also equals 2E×π2\mathbf E\times\boldsymbol\pi. Keeping the difference makes the operator ordering visible.

In the upper FW block, set β=1\beta=1 and Σ=σ\boldsymbol\Sigma=\boldsymbol\sigma. Define FP=π2−qℏσ⋅BF_{\rm P}=\boldsymbol\pi^2-q\hbar\boldsymbol\sigma\cdot\mathbf B. The result is

H+=mc2+qΦ+FP2m−FP28m3c2−qℏ28m2c2∇⋅E−qℏ8m2c2σ⋅(E×π−π×E)+⋯ .\begin{aligned} H_+={}&mc^2+q\Phi +\frac{F_{\rm P}}{2m} -\frac{F_{\rm P}^2}{8m^3c^2}\\ &-\frac{q\hbar^2}{8m^2c^2}\nabla\cdot\mathbf E\\ &-\frac{q\hbar}{8m^2c^2}\boldsymbol\sigma\cdot (\mathbf E\times\boldsymbol\pi -\boldsymbol\pi\times\mathbf E) +\cdots . \end{aligned}

The leading terms reproduce the Pauli Equation. The lower block is still part of the transformed one-particle Dirac equation; interpreting it as positive-energy antiparticles requires the field-theory reorganization explained in Negative-Energy Solutions.

For a purely electrostatic problem, choose A=0\mathbf A=0 and write V=qΦV=q\Phi. Then

H+=mc2+V+p22m−p48m3c2+ℏ28m2c2∇2V+ℏ4m2c2σ⋅(∇V×p)+⋯ .\begin{aligned} H_+={}&mc^2+V+\frac{\mathbf p^2}{2m}\\ &-\frac{\mathbf p^4}{8m^3c^2} +\frac{\hbar^2}{8m^2c^2}\nabla^2V\\ &+\frac{\hbar}{4m^2c^2} \boldsymbol\sigma\cdot(\nabla V\times\mathbf p) +\cdots . \end{aligned}

The second line contains the Darwin and spin–orbit operators. For a central potential, ∇V×p=V′(r)L/r\nabla V\times\mathbf p=V'(r)\mathbf L/r and S=ℏσ/2\mathbf S=\hbar\boldsymbol\sigma/2, giving

HSO=V′(r)2m2c2r L⋅S.H_{\rm SO} =\frac{V'(r)}{2m^2c^2r}\,\mathbf L\cdot\mathbf S.

For a Coulomb potential the Laplacian is a distribution. The contact term is interpreted through matrix elements or a specified finite-source limit, not by setting ∇2(1/r)=0\nabla^2(1/r)=0 everywhere.

If VV is constant, it commutes with O\mathcal O. The same algebra as in the exact free transformation diagonalizes the Hamiltonian through functional calculus, with the positive block

H+=V+m2c4+c2FP.H_+=V+\sqrt{m^2c^4+c^2F_{\rm P}}.

On a compatible self-adjoint realization, FP=(σ⋅π)2F_{\rm P}=(\boldsymbol\sigma\cdot\boldsymbol\pi)^2 is nonnegative even though its separate spin term can have either sign. For a spectral value f≥0f\geq0, Taylor’s theorem gives

0≤m2c4+c2f−mc2−f2m+f28m3c2≤f316m5c4.\begin{aligned} 0\leq{}& \sqrt{m^2c^4+c^2f} -mc^2-\frac{f}{2m} +\frac{f^2}{8m^3c^2}\\ \leq{}&\frac{f^3}{16m^5c^4}. \end{aligned}

Restricting to the spectral subspace 0≤FP≤Λ20\leq F_{\rm P}\leq\Lambda^2 therefore bounds the energy-operator remainder by Λ6/(16m5c4)\Lambda^6/(16m^5c^4). This is a genuine cutoff estimate for the magnetic square-root problem. It does not supply a remainder bound for arbitrary noncommuting electric potentials.

The first even kinetic term. Combine the terms [G,O][G,\mathcal O] and [G,[G,βM]]/2[G,[G,\beta M]]/2 in the first transformation. Why is the coefficient not βO2/M\beta\mathcal O^2/M?

Solution

The two contributions are respectively βO2/M\beta\mathcal O^2/M and −βO2/(2M)-\beta\mathcal O^2/(2M). Their sum is βO2/(2M)\beta\mathcal O^2/(2M). Keeping only the first commutator misses a contribution of exactly the same order.

An electric sign check. Let V(x)=kr2/2V(\mathbf x)=k r^2/2 with real kk and A=0\mathbf A=0. Find both electric corrections.

Solution

Since ∇2V=3k\nabla^2V=3k and ∇V=kx\nabla V=k\mathbf x,

HD=3kℏ28m2c2,HSO=k2m2c2L⋅S.H_{\rm D}=\frac{3k\hbar^2}{8m^2c^2},\qquad H_{\rm SO}=\frac{k}{2m^2c^2}\mathbf L\cdot\mathbf S.

Both signs follow from the potential energy VV, without guessing the sign of an electron’s charge.

Uniform magnetic-field counting. For B=Bz^\mathbf B=B\hat{\mathbf z}, B>0B>0, use a simultaneous eigenstate of π2\boldsymbol\pi^2 and σz\sigma_z with eigenvalues P2P^2 and s=±1s=\pm1. Compare the quartic correction with −P4/(8m3c2)-P^4/(8m^3c^2) alone.

Solution

The correct correction is

−(P2−qℏBs)28m3c2=−P4−2qℏBsP2+q2ℏ2B28m3c2.\begin{aligned} &-\frac{(P^2-q\hbar Bs)^2}{8m^3c^2}\\ &\quad=-\frac{P^4-2q\hbar BsP^2+q^2\hbar^2B^2} {8m^3c^2}. \end{aligned}

The omitted terms are not higher powers of 1/c1/c under fixed-field counting. The exact square-root spectrum expands in P2−qℏBsP^2-q\hbar Bs, which is nonnegative on the allowed magnetic eigenstates.

  • Foldy, Leslie L., and Siegfried A. Wouthuysen. “On the Dirac Theory of Spin 1/2 Particles and Its Non-Relativistic Limit.” Physical Review 78, 29–36 (1950). doi:10.1103/PhysRev.78.29.
  • Littlejohn, Robert G. “The Foldy-Wouthuysen Transformation.” Physics 221B, Notes 49, University of California, Berkeley, academic year 2021–22 (2021). Lecture notes.
  • Thaller, Bernd. The Dirac Equation. Springer (1992). doi:10.1007/978-3-662-02753-0.