Scattering Theory
Scattering Theory
From now on we assume that the potential V (r) is radially symmetric; it depends
only on the modulus r of the distance vector r and not on its orientation. The angular
momentum L = μr × ṙ is thus a conserved vector which always points in the same
direction, and both r and ṙ must lie in the plane perpendicular to this direction.
Any trajectory r(t) describing the scattering of the particle by the potential V (r)
is confined to a plane, the scattering plane. As already anticipated in Fig. 1.1, we
choose it to be the y–z plane, and we assume that the positive x-axis points in the
direction of L, so L = |L| = Lx ≥ 0.
For motion in the y–z plane, the polar coordinates r, θ are defined via
x ≡ 0, y = r sin θ, z = r cos θ, (1.5)
and the (conserved) angular momentum is
L = Lx = μ(y ż − zẏ) = −μr 2 θ̇ = μbυ∞ . (1.6)
Since the conserved energy is E = 12 μυ∞
2 , the impact parameter b is related to the
scattering experiment, the energy can be taken as fixed and known, so the observable
features are determined by the function Θ(b), which is called the deflection function.
We write the capital letter and emphasize that Θ retains the memory of possible
clockwise revolutions around the scattering centre.
One of the simplest conceivable scattering problems is the scattering by a hard
sphere of radius R as illustrated in the left-hand part of Fig. 1.2. The deflection angle
is π − 2φ, where sin φ = b/R,
b b
Θ(b) = π − 2 arcsin = 2 arccos for 0 ≤ b ≤ R. (1.9)
R R
Obviously, trajectories with b > R are not deflected, Θ(b) = 0 for b > R. The de-
flection function (1.9) is shown in the right-hand part of Fig. 1.2.
More realistic scattering problems involve a smooth potential V (r), for which
the scattering trajectory cannot be constructed by such simple geometric means. In
polar coordinates we have E = 12 μ(ṙ 2 + r 2 θ̇ 2 ) + V (r); with (1.8):
μ 2 L2
E= ṙ + + V (r). (1.10)
2 2μr 2
Equation (1.10) is a one-dimensional energy-conservation formula for the radial mo-
tion described by the coordinate r and the velocity ṙ. It shows that the evolution of
r(t) is as for one-dimensional motion of a particle with mass μ on the half-line r ≥ 0
under the influence of an effective potential, Veff . The effective potential consists of
the potential energy V (r) and the centrifugal potential Vcent (r), which comes from
the kinetic energy of angular motion and depends on the angular momentum L,
L2
Veff (r) = V (r) + Vcent (r), Vcent (r) =
. (1.11)
2μr 2
The effective potential helps us to understand the behaviour of a scattering
trajectory
√ for given energy E and impact parameter b (or angular momentum
L = b 2μE) in very straightforward terms. The scattering process begins with
r → ∞ for t → −∞, and r decreases with time until it reaches the classical turn-
ing point rctp , which fulfills
E = Veff (rctp ) (1.12)
4 1 Classical Scattering Theory
and corresponds to the point of closest approach of target and projectile. For the
hard-sphere case in Fig. 1.2, rctp is the sphere’s radius R as long as b ≤ R. If
Veff (r) < E for all r, then the radial turning point is the origin, rctp = 0. It is a useful
convention to choose the time of closest approach to be t = 0: r(t = 0) = rctp . For
later (positive) times, r increases again until r → ∞ for t → +∞.
The trajectory of the particle in the y–z-plane
√ is most conveniently obtained via
dθ/dr = θ̇ /ṙ with θ̇ from (1.8) and ṙ = ± (2/μ)[E − Veff (r)] from (1.10),
dθ L
= ± 2√ . (1.13)
dr r 2μ[E − Veff (r)]
During the first half of the scattering process, ṙ is negative (as is θ̇ ), so the plus sign
on the right-hand side of (1.13) applies. During the second half, ṙ is positive (in
contrast to θ̇ ), so (1.13) applies with the minus sign. The polar angle of the point of
closest approach, for which r = rctp , is
rctp ∞
dθ L dr
θ (r = rctp ) = π + dr = π − √ . (1.14)
∞ dr rctp r
2 2μ[E − Veff (r)]
For an actual calculation, the scattering trajectory (r, θ ) in the y–z plane can be
obtained via
r
L dr
θ (r) = θ (r = rctp ) ± √ , (1.15)
rctp r 2μ[E − Veff (r )]
2
where the plus sign gives the points on the incoming half of the trajectory and the
minus sign the points on the outgoing half. The deflection function follows from the
expression (1.15) for the polar angle in the limit r → ∞ on the outgoing branch of
the trajectory,
∞ ∞
L dr 2L dr
Θ(b) = θ (rctp ) − √ = π − √
rctp r
2 2μ[E − Veff (r)] rctp r
2 2μ[E − Veff (r)]
∞ 2 −1/2
2b b V (r)
=π − 2
1− 2 − dr. (1.16)
rctp r r E
In the limit of large impact parameters, the effective potential (1.11) is dominated
by the centrifugal term and the deflection angle tends to zero. For a potential falling
off asymptotically as an inverse power of r,
r→∞ Cα
V (r) ∼ , α > 0, (1.17)
rα
the large-b behaviour of Θ(b) is easily calculated analytically. Changing the inte-
gration variable in (1.16) from r to ξ = r/rctp gives, for large b,
∞
2 dξ rctp 2
Θ(b) = π − , where ε = − 1. (1.18)
1 ξ 4 − ξ 2 + ε(ξ 4 − ξ 4−α ) b
b→∞
Expanding the integrand in terms of the small parameter ε ∼ Cα /(E bα ) yields
√
b→∞ Cα πΓ (α) Cα π Γ ( α+1 2 )
Θ(b) ∼ = . (1.19)
E bα 2α−1 [Γ ( α2 )]2 Ebα Γ ( α2 )
1.2 Deflection Function 5
Fig. 1.3 Effective potential (1.21) for a repulsive (C > 0, left-hand part) and an attractive (C < 0,
right-hand part) Kepler–Coulomb interaction. The dotted lines show the respective potential (1.20)
without centrifugal contribution
Fig. 1.4 Scattering trajectories (left-hand part) and deflection function right-hand part for the
Kepler–Coulomb potential (1.20). The red (green) lines correspond to the repulsive (attractive)
case C > 0 (C < 0). Lengths are in units of |C|/(2E)
where the plus (minus) sign applies for the repulsive (attractive) case C > 0 (C < 0)
and the geometry of the trajectory is governed by the dimensionless parameter γ .
With ρ = r/b, Eqs. (1.14) and (1.15) are as follows for the Kepler–Coulomb case:
∞
dρ
θ (ρctp ) = π − ,
ρctp ρ ρ ∓ 2γρ − 1
2
ρ
dρ (1.23)
θ (ρ) = θ (ρctp ) ± .
ρctp ρ ρ 2 ∓ 2γρ − 1
The minus (plus) sign in the square root applies for the repulsive (attractive) case
C > 0 (C < 0). Typical trajectories are shown in the left-hand part of Fig. 1.4.
The axes are labelled with the b-independent dimensionless lengths ρ cos θ/γ ≡
z2E/|C|, ρ sin θ/γ ≡ y2E/|C|. The right-hand part of Fig. 1.4 shows the deflec-
tion function,
∞
2 dρ 1
Θ(b) = π − = ±2 arccos . (1.24)
ρctp ρ ρ 2 ∓ 2γρ − 1 γ2 +1
Fig. 1.5 Effective potential (1.26) for a repulsive (Cα > 0, left-hand part) and an attractive
(Cα < 0, right-hand part) inverse-power potential with α = 4. The dotted lines show the respective
potential (1.25) without centrifugal contribution
depend on the potential strength coefficient Cα , the impact parameter b and the
energy E independently, but only on the ratio of Cα to the product Ebα . Although
we are mainly interested in integer values of α on physical grounds, the discussion
below is largely valid also for noninteger, real and positive α.
As a generalization of (1.21) we define
2
μ|Cα | 1/(α−2) L2 2 rL α rL
rL = α , so Veff (r) = ± + . (1.26)
L2 2μrL2 α r r
For Cα > 0, the plus sign in the square bracket applies; the effective potential is a
monotonically decreasing function of r. For Cα = −|Cα | < 0, the minus sign ap-
plies, Veff (r) has a zero at rL (2/α)1/(α−2) and an extremum at rL . For α < 2 this
extremum is a minimum, as in Sect. 1.2.1. For α > 2, the extremum is a maximum.
Such a “centrifugal barrier” is a characteristic property of all potentials with at-
tractive tails falling off faster than −1/r 2 . For the inverse-power tail (1.25) with
Cα < 0, the centrifugal barrier has its maximum at rL and the barrier height is
Veff (rL ) = [1 − 2/α]L2 /(2μrL2 ) > 0. The effective potential (1.26) is shown for
α = 4, both for the repulsive and for the attractive case in Fig. 1.5.
Using (1.7), the equation defining turning points of the effective potential (1.26)
can be written as
b 2 2 b α α |Cα |
1− =± γ with γ = . (1.27)
rctp α rctp 2 Ebα
In the repulsive case [plus sign in (1.27)], there is always one real solution for rctp .
In the attractive case, Eq. (1.27) always has one real solution for rctp if α < 2.
For an attractive potential with α > 2, Eq. (1.27) has no real solutions for large γ
and two real solutions for small γ . For the value γorb separating these two regimes,
the total energy E is exactly equal to the height Veff (rL ) of the centrifugal barrier
8 1 Classical Scattering Theory
Fig. 1.6 Scattering trajectories (left-hand part) and deflection function (right-hand part) for the
inverse-power potential (1.25) with α = 4. The red (green) lines correspond to the repulsive (at-
tractive) case C4 > 0 (C4 < 0). Lengths are in units of (2|C4 |/E)1/4
for a given r0 with appropriate constants c1,2 . Since (α − 2)/2 > 0, the polar angle
converges to a finite limit during the crash to the origin.
Typical scattering trajectories are shown in the left-hand part of Fig. 1.6 for the
inverse-power potential (1.25) with α = 4. In this case γ = 2|C4 |/(Eb4 ). For γ =
γorb = 12 and C4 < 0, the incoming trajectory approaches the circular orbit for t →
+∞. For smaller impact parameters, γ > γorb , the incoming trajectory crashes into
the origin and an outgoing trajectory cannot be determined unambiguously without
further assumptions. The deflection function Θ(b) is shown in the right-hand part
of Fig. 1.6. The abscissa is labelled with b in units of the length (2|C4 |/E)1/4 , i.e.
with 1/γ 1/4 . For C4 > 0, Θ(b) decreases monotonically from Θ(0) = π to zero;
for C4 < 0, Θ(b) increases monotonically from −∞ in the orbiting case to zero.
b→∞
According to (1.19), Θ(b) ∼ ±3πγ /8.
1.2 Deflection Function 9
Realistic potentials have more structure than the inverse-power potentials discussed
above. For example, the interaction of two neutral atoms with each other is char-
acterized at large distances by an attractive tail proportional to −1/r 6 , and it is
strongly repulsive at very short distances comparable to the size of the atoms. A pop-
ular model for describing interatomic interactions is the Lennard–Jones potential,
C12 C6 rmin 12 rmin 6
VLJ (r) = 12 − 6 = E −2 . (1.32)
r r r r
It has a minimum at rmin = (2C12 /C6 )1/6 , and VLJ (rmin ) = −E = −C6 2 /(4C12 ).
We express the angular momentum in terms of a dimensionless quantity Λ,
L rmin 12 rmin 6 rmin 2
Λ= √ , so Veff = E −2 + Λ2 .
rmin 2μE r r r
(1.33)
Λ2 is the ratio of the centrifugal potential at rmin to the depth E of the poten-
tial (1.32). Figure 1.7 shows the effective potential (1.33) for Λ2 = 0, 1, 2 and 3.
Note that Veff (r) only has a local maximum if the angular momentum is less than a
limiting value, Λ < Λorb . For Λ = Λorb , Veff has a horizontal point of inflection at
(r ) = 0 and V (r ) = 0 we get
rorb . From Veff orb eff orb
10 1 Classical Scattering Theory
1/6
rorb 5
= ≈ 1.165,
rmin 2
(1.34)
18 2 2/3 Veff (rorb ) 4
Λ2orb = ≈ 1.954 and = .
5 5 E 5
If E < 45 E , there will be an appropriate angular momentum Λ < Λorb for which
the maximum of Veff , i.e. the top of the centrifugal barrier, coincides with E, so the
conditions for orbiting are fulfilled. For E = 45 E , orbiting occurs for Λ = Λorb . If
E > 45 E , there is no orbiting.
Scattering trajectories are shown in Fig. 1.8 at energy E/E = 1/(1.09)2 ≈ 0.84,
which is just above
the energy for which orbiting is possible. The impact parame-
ters b = rmin Λ E /E correspond to Λ2 = 1, 2 and 3 as featured in Fig. 1.7. In the
closest collision (Λ2 = 1), the particle passes above the centrifugal barrier associ-
ated with the attractive −1/r 6 potential tail, but instead of crashing into the origin
it is reflected off the repulsive 1/r 12 core at short distances. For the largest impact
parameter (Λ2 = 3), the radial motion is reflected by the centrifugal barrier, and the
1.3 Scattering Angle and Scattering Cross Sections 11
particle only weakly feels the attractive tail of the potential. The case in between,
Λ2 = 2, is close to the orbiting situation and the particle almost fulfills a complete
revolution before leaving the interaction region.
Deflection functions for the Lennard–Jones potential (1.32) are shown in Fig. 1.9
for three energies. For E/E = 0.6, orbiting occurs at Λ ≈ 1.281. For E/E = 0.9
and 1.2, orbiting is no longer possible, but pronounced minima of Θ with gradually
decreasing depths remain.
in Fig. 1.10, for which Θ(b) = θ . However, there may also be particles with in-
coming trajectories below the z-axis, corresponding to a scattering plane rotated
by π around the z-axis. An example is given by the dashed trajectory in Fig. 1.11
Such particles are detected under the scattering angle θ if Θ(b) = −θ . A scattering
experiment in three dimensions usually does not discriminate between these two
possibilities. Furthermore, one or more revolutions around the scattering centre are
not detected, so observation under the scattering angle θ records all particles with
impact parameter b for which ±(Θ(b) + 2Mπ) = θ , i.e.,
Θ(b) = ±θ − 2Mπ, M = 0, 1, 2 . . . . (1.36)
The case b = b3 in Fig. 1.11 is an example for Θ(b) = θ − 2π .
The differential scattering cross section as function of the scattering angle θ is
obtained by summing the contributions (1.35) over all impact parameters fulfill-
ing (1.36),
dσ bi db bi dΘ −1
(θ ) = = . (1.37)
dΩ sin θ dθ sin θ db bi
i i
The area dσ corresponds to the area perpendicular to the incoming beam, through
which all trajectories pass which are scattered into the solid angle dΩ. The expres-
sion on the far right of (1.37) is often preferred, because Θ(b) is an unambiguous
function of the impact parameter b, defined on the interval [0, ∞). In the preceed-
ing expression, different terms in the sum correspond to different branches of the
multivalued function b(θ ).
1.3 Scattering Angle and Scattering Cross Sections 13
The Kepler–Coulomb potential V (r) = C/r was introduced in Sect. 1.2.1, Eq. (1.20).
The deflection function Θ(b) is given in (1.24) and shown in the right-hand part of
Fig. 1.4. It is a bijective mapping of the interval [0, ∞) onto a finite interval of
deflection angles: (0, π] in the repulsive case C > 0 and [−π, 0) in the attractive
case C < 0. The relation between scattering angle and deflection angle is θ = Θ for
C > 0 and θ = −Θ for C < 0. Explicitly,
1
Θ(b) = ±2 arccos ,
γ2 +1
(1.41)
|C| θ C θ
γ= = tan ⇒ b=
2E cot 2 .
2Eb 2
The differential scattering cross section follows via (1.37),
db |C| 1 dσ C 2 1 dσ
=
dθ 4E sin2 (θ/2) , so dΩ = 4E sin4 (θ/2) = dΩ , (1.42)
Ruth
14 1 Classical Scattering Theory
and it is shown in Fig. 1.12. This is the famous Rutherford formula for the dif-
ferential cross section in Coulomb scattering. It does not discriminate between the
repulsive case C > 0 and the attractive case C < 0.
For an inverse-square potential (1.30) with C2 < 0, particles crash into the origin if
√
b ≤ |C2 |/E. If all these particles are absorbed,
|C2 |
σabs = π , (1.45)
E
which corresponds to the result (1.44) in the limit α → 2.
16 1 Classical Scattering Theory
The Lennard–Jones potential (1.32) was discussed in Sect. 1.2.3, and deflection
functions are shown in Fig. 1.9 for three energies. Differential scattering cross sec-
tions are shown in Fig. 1.14 for the same energies. At the lowest energy, E = 0.6E ,
orbiting occurs and the behaviour of the cross section is qualitatively similar to that
of the attractive 1/r 4 potential shown in Fig. 1.13: there is divergence at backward
angles corresponding to glory scattering, and the generic forward divergence. At
E = 0.9E , there is no orbiting, but the deflection function passes −π for two finite
values of the impact parameter, so glory scattering is still observable.
The deflection function at E = 0.9E has a minimum value Θmin ≈ −1.39π for
Λ ≈ 1.45. At the corresponding scattering angle, θR = Θmin + 2π ≈ 0.61π , the dif-
ferential scattering cross section (1.37) diverges, because dΘ/db vanishes. Such a
divergence is called a rainbow singularity, because an analogous effect in light scat-
tering is responsible for the rainbows in the sky [1]. The corresponding scattering
angle θR is the rainbow angle. For θ > θR ≈ 0.61π , there are five branches of b(θ )
contributing to the scattering cross section (1.37), namely two with θ = Θ + 2π ,
two with θ = −Θ and one with θ = Θ. The two branches with θ = Θ + 2π co-
alesce at θR and no longer contribute for θ < θR , so only the three contributions
with θ = ±Θ remain. For this rainbow, the regime θ < θR is the dark side of the
rainbow, while the regime θ > θR is the bright side of the rainbow. The differential
cross section (1.37) is noticeably smaller on the dark side of a rainbow than on the
bright side.
At E = 1.2E , the deflection function has a minimum Θmin ≈ −0.71π at Λ ≈
1.56. The rainbow angle is now θR = −Θmin , and the dark side of the rainbow is
θ > θR , while θ < θR is the bright side. Note that Θ(b) never passes an odd multiple
of π beyond b = 0, so there is no glory scattering at E = 1.2E .
1.4 Classical Scattering in Two Spatial Dimensions 17
Θ(b) = −θ − 2Mπ , the negative impact parameter −b leads to the deflection angle
Θ(−b) = θ + 2Mπ because of (1.46). Trajectories of particles scattered into −θ
are the reflections at the z-axis of those scattered into θ .
Adapting (1.36) to the two-dimensional case we formulate: A given scattering an-
gle θ ∈ (−π, π) accommodates all particles with impact parameters b ∈ (−∞, ∞)
for which
Θ(b) = θ − 2Mπ, M = 0, ±1, ±2 . . . . (1.47)
Equation (1.8) in Sect. 1.2 can be generalized to accommodate negative angular
momenta, for which θ (t) is a monotonically increasing function of time. One con-
sequence is, that the integer M on the right-hand side of (1.47) can only be negative
for negative impact parameters b, while it can only be positive for positive b, as
already formulated in (1.36).
The differential dλ is a quantitative measure for the number of particles scattered
into angles between θ and θ + dθ per unit time, normalized to the incoming current
density nυ∞ . For each impact parameter fulfilling (1.47), these particles are those
with incoming trajectories passing through the differential length db as shown in
Fig. 1.15. The number of particles scattered into dθ per unit time is nυ∞ × db, so
db
dλ ≡ db = dθ. (1.48)
dθ
The differential scattering cross section as function of the scattering angle θ is
obtained by summing the contributions (1.48) over all impact parameters fulfill-
ing (1.47),
dλ db dΘ −1
= dθ = db . (1.49)
dθ bi
i i
The length dλ corresponds to the length perpendicular to the incoming beam,
through which all particles pass that are scattered into the angle dθ . From the sym-
metry with respect to reflection at the z-axis, it follows that the differential scattering
cross section (1.49) is an even function of θ .
1.4 Classical Scattering in Two Spatial Dimensions 19
(θ ) ∼ |θ | . (1.54)
dθ 2D α dΩ 3D
20 1 Classical Scattering Theory
For the Kepler–Coulomb potential V (r) = C/r, the deflection function is given
analytically in (1.24) and displayed for the 2D situation in Fig. 1.16. The differential
scattering cross section in 2D follows immediately via (1.49),
dλ |C| 1
= . (1.55)
dθ 4E sin2 (θ/2)
In this case, the relation (1.54), with α = 1, is not only valid asymptotically for
θ → 0; it is an equality for all scattering angles.
The cross sections for the other examples discussed in Sect. 1.3 can also be de-
rived via (1.49) using the deflection functions given in Sect. 1.2. Apart from the
slower divergence at forward angles, a main difference is the absence of the glory
singularity, which is due to the factor 1/ sin θ in the 3D case. A main manifesta-
tion of orbiting and near-orbiting situations in 3D scattering, namely glory scat-
tering at backward angles, is thus missing in the 2D cross sections. Figure 1.17
shows the differential scattering cross section (1.49) for an inverse-power potential
V (r) = C4 /r 4 . The ordinate is labelled with the cross section in units of the length
(2|C4 |/E)1/4 .
For scattering by an attractive inverse-power potential V (r) = Cα /r α , with
α > 2, orbiting occurs for impact parameters |b| = borb , with borb given by (1.43).
Assuming that all particles with impact parameters |b| < borb are absorbed, the ab-
sorbtion cross section is
The differential cross section for scattering by the Lennard–Jones potential (1.32)
in two dimensions follows via (1.49)—and (1.46)—from the deflection functions
discussed in Sect. 1.3.3, see Fig. 1.9. They are shown in Fig. 1.18 for the same
energies as in Fig. 1.9 and Sect. 1.3.3. The rainbow singularities for E = 0.9E (at
θR ≈ 0.61π ) and for E = 1.2E (at θR ≈ 0.71π ) are manifest, as in the 3D case.
References 21
References
1. Adam, J.A.: The mathematical physics of rainbows and glories. Phys. Rep. 356, 229–365
(2002)
2. Landau, L.D., Lifshitz, E.M.: Course of Theoretical Physics. Mechanics, vol. 1. 3rd edn.
Butterworth-Heinemann, Stoneham (1976)