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Low-Energy S-Wave Scattering

This worked problem turns low-energy universality into a quantitative approximation test. An attractive spherical square well is tuned to have a scattering length ten times its range. The exact ss-wave solution is then compared with:

  1. the scattering-length amplitude;
  2. the effective-range approximation;
  3. the ss-wave unitarity bound;
  4. the exact shallow-bound-state pole.

The point is not that a square well is a realistic microscopic interaction. It is that one exactly solvable short-range model makes every scale and every omitted term visible. Low-Energy Scattering owns the general universality statement, while Square-Well Scattering owns the full finite-energy matching problem in all partial waves.

Consider relative motion with reduced mass μ\mu in

V(r)={−V0,0≤r<R,0,r>R,V0>0.V(r) = \begin{cases} -V_0, & 0\le r<R, \\ 0, & r>R, \end{cases} \qquad V_0>0.

Define the range energy and dimensionless variables

ER=ℏ22μR2,x=kR,g=R2μV0ℏ.\begin{aligned} E_R &= \frac{\hbar^2}{2\mu R^2}, \\ x &= kR, \\ g &= \frac{R\sqrt{2\mu V_0}}{\hbar}. \end{aligned}

The well depth is V0/ER=g2V_0/E_R=g^2. At positive collision energy,

E=ℏ2k22μ,E = \frac{\hbar^2k^2}{2\mu},

the interior wave number qq obeys

y≡qR=g2+x2.y \equiv qR = \sqrt{g^2+x^2}.

The target is the elastic ss-wave cross section for distinguishable particles. Identical-particle factors are discussed separately below.

The calculation uses the exact square-well phase shift as an independent benchmark. It then deliberately discards short-distance information in stages:

Kexact(k)≡kcot⁡δ0(k),KERE(k)=−1a+12rek2,Kuniv(k)=−1a.\begin{gathered} K_{\mathrm{exact}}(k) \equiv k\cot\delta_0(k), \\ K_{\mathrm{ERE}}(k) = -\frac1a + \frac12r_e k^2, \\ K_{\mathrm{univ}}(k) = -\frac1a. \end{gathered}

All three are inserted into the same unitary amplitude

f0(k)=1K(k)−ik.f_0(k) = \frac{1}{K(k)-ik}.

This comparison separates two issues that are often mixed together:

  • keeping the exact unitarity denominator −ik-ik;
  • approximating the real short-range function K(k)=kcot⁡δ0(k)K(k)=k\cot\delta_0(k).

The scattering-length approximation is nonperturbative in kaka even though it is the leading term in an expansion in the interaction range.

For the regular reduced radial wavefunction,

u0in(r)∝sin⁡(qr),u0out(r)∝sin⁡(kr+δ0).\begin{aligned} u_0^{\mathrm{in}}(r) &\propto \sin(qr), \\ u_0^{\mathrm{out}}(r) &\propto \sin(kr+\delta_0). \end{aligned}

Matching logarithmic derivatives at r=Rr=R gives

ycot⁡y=xcot⁡(x+δ0).y\cot y = x\cot(x+\delta_0).

It is convenient to define

T(x)=xytan⁡y.T(x) = \frac{x}{y}\tan y.

The matching condition becomes

tan⁡(x+δ0)=T(x).\tan(x+\delta_0) = T(x).

Using the tangent subtraction identity gives an exact expression without choosing a phase branch:

tan⁡δ0=T(x)−tan⁡x1+T(x)tan⁡x.\tan\delta_0 = \frac{T(x)-\tan x} {1+T(x)\tan x}.

Therefore the exact dimensionless effective-range function is

Kexact(x)≡xcot⁡δ0=x1+T(x)tan⁡xT(x)−tan⁡x.\mathcal K_{\mathrm{exact}}(x) \equiv x\cot\delta_0 = x \frac{1+T(x)\tan x} {T(x)-\tan x}.

No inverse tangent appears, so this formula is continuous through points where δ0\delta_0 crosses π/2\pi/2.

The exact square-well scattering length is

a=R(1−tan⁡gg).a = R\left( 1-\frac{\tan g}{g} \right).

Write

A≡aR.A \equiv \frac{a}{R}.

The benchmark is chosen by imposing

A=10.A=10.

The first solution above the one-bound-state threshold g=π/2g=\pi/2 is

g=1.63850515464009.g = 1.63850515464009.

It satisfies

1−tan⁡gg=101-\frac{\tan g}{g} = 10

and corresponds to

V0ER=g2=2.68469914178214.\frac{V_0}{E_R} = g^2 = 2.68469914178214.

The well is therefore just deep enough to support one shallow ss-wave bound state. The large scattering length is caused by this nearby pole, not by a geometrically large potential range.

Expanding the exact matching formula at small xx gives

xcot⁡δ0=−1A+12reRx2+O(x4).x\cot\delta_0 = -\frac{1}{A} + \frac12 \frac{r_e}{R} x^2 + O(x^4).

For an attractive square well,

reR=1−1g2A−13A2.\frac{r_e}{R} = 1 - \frac{1}{g^2A} - \frac{1}{3A^2}.

At the tuned point,

reR=0.959418545101128.\frac{r_e}{R} = 0.959418545101128.

Thus the three real functions to be compared are

ce≡re2R=0.479709272550564,Kexact(x)=xcot⁡δ0(x),KERE(x)=−0.1+cex2,Kuniv(x)=−0.1.\begin{aligned} c_e &\equiv \frac{r_e}{2R} = 0.479709272550564, \\ \mathcal K_{\mathrm{exact}}(x) &= x\cot\delta_0(x), \\ \mathcal K_{\mathrm{ERE}}(x) &= -0.1 + c_e x^2, \\ \mathcal K_{\mathrm{univ}}(x) &= -0.1. \end{aligned}

The scattering-length result removes all information about the range except through the fitted value of aa. The effective-range result restores one additional short-distance number.

In dimensionless form,

f0(k)R=1K(x)−ix.\frac{f_0(k)}{R} = \frac{1} {\mathcal K(x)-ix}.

For distinguishable particles, define

Σ(x)≡σ04πR2.\Sigma(x) \equiv \frac{\sigma_0}{4\pi R^2}.

Then

Σ(x)=1K(x)2+x2.\Sigma(x) = \frac{1} {\mathcal K(x)^2+x^2}.

The scattering-length prediction is

Σuniv(x)=A21+A2x2=1001+100x2.\Sigma_{\mathrm{univ}}(x) = \frac{A^2}{1+A^2x^2} = \frac{100}{1+100x^2}.

The effective-range prediction is

ΣERE(x)=1[−0.1+cex2]2+x2.\Sigma_{\mathrm{ERE}}(x) = \frac{1} {\left[ -0.1+c_e x^2 \right]^2+x^2}.

Exact, scattering-length, and effective-range predictions for the s-wave effective-range function and cross section of a tuned square well.

The tuned well has a=10Ra=10R and re=0.959419Rr_e=0.959419R. The scattering-length approximation keeps the exact −ik-ik unitarity term but replaces kcot⁡δ0k\cot\delta_0 by −1/a-1/a. The effective-range term tracks the exact model much farther toward kR∼1kR\sim1. In the intermediate window 1/a≪k≪1/R1/a\ll k\ll1/R, the cross section approaches the ss-wave unitarity bound.

The large hierarchy a/R=10a/R=10 separates three momentum regions.

When

k∣a∣ll1,k|a|ll1,

or x≪0.1x\ll0.1 here,

f0≃−a,σ0≃4πa2.f_0 \simeq -a, \qquad \sigma_0 \simeq 4\pi a^2.

The normalized cross section approaches

Σ(0)=A2=100.\Sigma(0) = A^2 = 100.

If the scale separation is large enough to allow

1∣a∣≪k≪1R,\frac1{|a|} \ll k \ll \frac1R,

then −ik-ik dominates over both −1/a-1/a and range corrections. The amplitude becomes

f0(k)≃ik,f_0(k) \simeq \frac{i}{k},

and the cross section approaches

σ0≃4πk2.\sigma_0 \simeq \frac{4\pi}{k^2}.

This is the ss-wave unitarity limit. It is large and nonperturbative even though the collision energy is low.

When

kR∼1,kR \sim 1,

the collision resolves the interaction range. The effective range, shape parameter, and eventually higher partial waves matter. Agreement of a low-order formula at one such momentum is not a general universality guarantee.

The exact and approximate normalized cross sections are:

x=kRx=kRExact Σ\SigmaScattering lengthRelative errorEffective rangeRelative error
0.020.0296.509696.509696.153896.1538−0.369%-0.369\%96.509696.5096−9.4×10−6%-9.4\times10^{-6}\%
0.100.1052.457652.457650.000050.0000−4.68%-4.68\%52.456052.4560−0.00305%-0.00305\%
0.200.2021.494921.494920.000020.0000−6.95%-6.95\%21.491321.4913−0.0170%-0.0170\%
0.400.406.230366.230365.882355.88235−5.59%-5.59\%6.228966.22896−0.0224%-0.0224\%
0.600.602.733092.733092.702702.70270−1.11%-1.11\%2.737592.73759+0.165%+0.165\%
1.001.000.8550210.8550210.9900990.990099+15.8%+15.8\%0.8739890.873989+2.22%+2.22\%

Two points deserve emphasis.

First, kR=0.1kR=0.1 is small, but the scattering-length result already has a several-percent error. Near the threshold plateau, the relative size of the effective-range term is set by

12arek2,\frac12a r_e k^2,

which is enhanced by the large ratio a/Ra/R.

Second, the excellent effective-range agreement through x≃0.6x\simeq0.6 is a property of this benchmark, not a theorem that every short-range potential behaves equally well. The omitted shape term is O(k4R3)O(k^4R^3), and its coefficient is model dependent.

For a bound state, analytically continue to

k=iκ,κ>0.k=i\kappa, \qquad \kappa>0.

The scattering-length amplitude has a pole at

κuniv=1a,κunivR=0.1.\kappa_{\mathrm{univ}} = \frac1a, \qquad \kappa_{\mathrm{univ}}R = 0.1.

Its universal binding energy is

EbunivER=(κR)2=0.01.\frac{E_b^{\mathrm{univ}}}{E_R} = (\kappa R)^2 = 0.01.

Including the effective range gives the pole equation

−1a−12reκ2+κ=0.-\frac1a - \frac12r_e\kappa^2 + \kappa = 0.

The two algebraic roots are

κ±=1±1−2re/are.\kappa_{\pm} = \frac{1\pm\sqrt{1-2r_e/a}} {r_e}.

The shallow root is

κ−R=0.105321201747655.\kappa_-R = 0.105321201747655.

The second root,

κ+R=1.97927473420977,\kappa_+R = 1.97927473420977,

lies beyond the low-energy domain. It must not be promoted to a physical prediction of the truncated expansion.

For the exact square well, write

ζ=κR,b=g2−ζ2.\zeta = \kappa R, \qquad b = \sqrt{g^2-\zeta^2}.

Matching the decaying exterior solution gives

bcot⁡b=−ζ.b\cot b = -\zeta.

The shallow exact solution is

ζexact=0.105317031281676,\zeta_{\mathrm{exact}} = 0.105317031281676,

so

EbexactER=0.0110916770779855.\frac{E_b^{\mathrm{exact}}}{E_R} = 0.0110916770779855.

The scattering-length energy is low by 9.84%9.84\%. The effective-range energy,

EbEREER=0.0110925555375702,\frac{E_b^{\mathrm{ERE}}}{E_R} = 0.0110925555375702,

differs from the exact result by only 0.00792%0.00792\%.

This pole comparison is independent of the positive-energy cross-section table. It tests the analytic continuation of the same low-energy parameters.

At leading order, every short-range elastic interaction with the same real scattering length has

f0(k)=−a1+ikaf_0(k) = -\frac{a}{1+ika}

up to range corrections. The microscopic potential may be a square well, a smooth well, a multichannel interaction reduced to one open channel, or a regulated contact theory.

Universality does not say that:

  • the wavefunction inside the interaction region is universal;
  • the effective range is fixed by the scattering length;
  • higher partial waves are always absent;
  • inelastic channels can be represented by a real aa;
  • a large positive and large negative aa have the same pole interpretation;
  • two-body universality determines all three-body observables.

For a>0a>0 with a≫Ra\gg R, the pole at k≃i/ak\simeq i/a is a shallow bound state. For a<0a<0, the corresponding near-threshold pole lies at k≃−i/∣a∣k\simeq-i/|a| on the unphysical sheet and is usually called a virtual state. Their leading cross sections depend on a2a^2, but their analytic structures differ.

For the scattering-length amplitude, the first omitted term in K(k)K(k) is rek2/2r_e k^2/2. A useful local diagnostic is

ϵr(k)=∣re∣k2/2max⁡(1/∣a∣,k).\epsilon_r(k) = \frac{|r_e|k^2/2} {\max(1/|a|,k)}.

This compares the omitted real term with the real or imaginary scale already retained in the denominator. It is a diagnostic rather than a rigorous bound.

For the effective-range approximation, the next term has the form

Pk4,P k^4,

where PP is a shape parameter with dimensions of length cubed. Natural short-range power counting suggests P=O(R3)P=O(R^3) unless a further tuning or long-range tail changes the scale.

A trustworthy numerical test should therefore vary kRkR, compare the extracted kcot⁡δ0k\cot\delta_0 rather than only the cross section, and verify that the radial integration domain and matching radius are converged. Phase Shift Extraction gives that workflow.

The formulas above use distinguishable-particle normalization:

σ0=4π∣f0∣2.\sigma_0 = 4\pi|f_0|^2.

For identical spinless bosons in a pure ss wave, symmetrization doubles the amplitude while the final-state phase space must not be counted twice. The result is

σ0boson=8π∣f0∣2.\sigma_0^{\mathrm{boson}} = 8\pi|f_0|^2.

For identical spin-polarized fermions, the spatial state must be antisymmetric and the ss wave is forbidden. The leading channel is then usually pp wave. Identical-Particle Scattering owns the complete symmetry conventions.

  1. Dimensions. Both aa and rer_e have dimensions of length, while kcot⁡δ0k\cot\delta_0 has dimensions of inverse length.
  2. Threshold. The exact formula gives K(0)=−R/a=−0.1\mathcal K(0)=-R/a=-0.1 and Σ(0)=100\Sigma(0)=100.
  3. Unitarity. Every real approximation to K(k)K(k) inserted into [K(k)−ik]−1[K(k)-ik]^{-1} satisfies the elastic single-channel unitarity form.
  4. Pole consistency. The same aa and rer_e describe the positive-energy amplitude and the shallow bound-state continuation.
  5. Range counting. The universal and effective-range curves separate only when the collision begins to resolve RR or when the large value of aa amplifies the nominally small k2k^2 term.
  6. Exact benchmark. The physical ERE pole agrees with the exact square-well pole, while the deep algebraic root lies outside the expansion domain.
  • Replacing f0f_0 by −a-a when k∣a∣k|a| is not small.
  • Calling the scattering-length formula perturbative in kaka even though it resums ikaika exactly.
  • Assuming kR≪1kR\ll1 alone guarantees that effective-range corrections are negligible when ∣a∣/R|a|/R is large.
  • Dropping the −ik-ik term and thereby violating the correct elastic unitarity denominator.
  • Treating every positive scattering length as evidence for an accurately universal shallow bound state.
  • Interpreting the deep root of a truncated effective-range equation as a reliable state.
  • Inferring bound versus virtual character from a cross section that depends only on a2a^2.
  • Using the distinguishable-particle factor 4π4\pi for identical bosons without checking conventions.
  • Applying short-range universality to an unscreened Coulomb interaction.
  • Extending the two-body result to three-body physics without the additional parameters required there.
  • H. A. Bethe, “Theory of the Effective Range in Nuclear Scattering,” Physical Review 76, 38–50 (1949), doi:10.1103/PhysRev.76.38.
  • J. M. Blatt and J. D. Jackson, “On the Interpretation of Neutron–Proton Scattering Data by the Schwinger Variational Method,” Physical Review 76, 18–37 (1949), doi:10.1103/PhysRev.76.18.
  • J. R. Taylor, Scattering Theory: The Quantum Theory of Nonrelativistic Collisions, Dover, 2006.
  • R. G. Newton, Scattering Theory of Waves and Particles, 2nd ed., Dover, 2002.
  • L. D. Landau and E. M. Lifshitz, Quantum Mechanics: Non-Relativistic Theory, 3rd ed., Pergamon, 1977.
  • E. Braaten and H.-W. Hammer, “Universality in Few-Body Systems with Large Scattering Length,” Physics Reports 428, 259–390 (2006), arXiv:cond-mat/0410417.
  • C. Chin, R. Grimm, P. Julienne, and E. Tiesinga, “Feshbach Resonances in Ultracold Gases,” Reviews of Modern Physics 82, 1225–1286 (2010), doi:10.1103/RevModPhys.82.1225.

1. Derive the exact effective-range function

Section titled “1. Derive the exact effective-range function”

Starting from tan⁡(x+δ0)=T(x)\tan(x+\delta_0)=T(x), derive

xcot⁡δ0=x1+T(x)tan⁡xT(x)−tan⁡x.x\cot\delta_0 = x \frac{1+T(x)\tan x} {T(x)-\tan x}.
Solution

Use

tan⁡(x+δ0)=tan⁡x+tan⁡δ01−tan⁡xtan⁡δ0=T.\tan(x+\delta_0) = \frac{\tan x+\tan\delta_0} {1-\tan x\tan\delta_0} = T.

Solving for tan⁡δ0\tan\delta_0 gives

tan⁡δ0=T−tan⁡x1+Ttan⁡x.\tan\delta_0 = \frac{T-\tan x} {1+T\tan x}.

Taking the reciprocal and multiplying by xx gives

xcot⁡δ0=x1+Ttan⁡xT−tan⁡x.x\cot\delta_0 = x \frac{1+T\tan x} {T-\tan x}.

For a=10Ra=10R, identify the momentum inequalities required for the universal amplitude to approach i/ki/k. Why is the window only parametrically clean rather than broad in this benchmark?

Solution

The scattering-length term is negligible compared with kk when

k≫1a=0.1R.k\gg\frac1a = \frac{0.1}{R}.

Range corrections remain small when

k≪1R.k\ll\frac1R.

Thus the desired window is

0.1≪kR≪1.0.1 \ll kR \ll 1.

The hierarchy spans only one decade because a/R=10a/R=10. A much larger scattering length would create a broader region in which 1/a1/a and 1/R1/R are well separated.

At kR=0.1kR=0.1, estimate the ratio of the effective-range term to 1/a1/a and compare it with the cross-section error of the scattering-length approximation.

Solution

The ratio is

rek2/21/a=12arek2.\frac{r_e k^2/2}{1/a} = \frac12a r_e k^2.

Using a=10Ra=10R, re=0.959419Rr_e=0.959419R, and kR=0.1kR=0.1 gives

12arek2=12(10)(0.959419) (0.1)2≃0.04797.\begin{aligned} \frac12a r_e k^2 &= \frac12(10)(0.959419) \,(0.1)^2 \\ &\simeq 0.04797. \end{aligned}

The real denominator is shifted by about 4.8%4.8\%, and the exact cross-section comparison shows a 4.68%4.68\% error. The close numerical agreement is specific to this point, but the scale estimate correctly predicts a several-percent effect.

The effective-range pole equation has roots κ−R=0.105321\kappa_-R=0.105321 and κ+R=1.97927\kappa_+R=1.97927. Explain why only the first is controlled.

Solution

The effective-range expansion is a low-momentum expansion requiring ∣k∣R≪1|k|R\ll1. The shallow root satisfies

κ−R≃0.105,\kappa_-R \simeq 0.105,

so it lies inside the intended domain and agrees with the exact pole. The second root has κ+R≃1.98\kappa_+R\simeq1.98, beyond the range scale. It is an algebraic feature of the truncated quadratic denominator, not a controlled prediction of a second bound state.

5. Change the sign of the scattering length

Section titled “5. Change the sign of the scattering length”

Keep ∣a∣=10R|a|=10R but take a<0a<0 in the scattering-length amplitude. Show that the leading cross section is unchanged and classify the pole.

Solution

The cross section is

σ0=4πa21+k2a2,\sigma_0 = \frac{4\pi a^2} {1+k^2a^2},

so it depends only on a2a^2 and is unchanged under a→−aa\to-a.

The amplitude denominator vanishes at

k=ia.k = \frac{i}{a}.

For a=−∣a∣a=-|a|, this is

k=−i∣a∣.k = -\frac{i}{|a|}.

The pole is not a normalizable bound state on the positive imaginary axis. It is the universal near-threshold virtual-state pole on the unphysical sheet.

For identical spinless bosons with only ss-wave scattering, derive the factor of two relative to the distinguishable-particle total cross section.

Solution

The symmetrized amplitude is

fB(θ)=f(θ)+f(π−θ).f_{\mathrm B}(\theta) = f(\theta) + f(\pi-\theta).

For an isotropic ss wave, both terms equal f0f_0, so the amplitude is 2f02f_0. Identical final states must not be counted twice, giving

σ0boson=12∫dΩ ∣2f0∣2=8π∣f0∣2.\sigma_0^{\mathrm{boson}} = \frac12 \int d\Omega\, |2f_0|^2 = 8\pi|f_0|^2.

This is twice the distinguishable result 4π∣f0∣24\pi|f_0|^2.