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University physics · Advanced undergraduate / beginning graduate

Advanced Quantum Mechanics

Derive the results earlier courses quoted. Connect symmetry, relativistic wave equations and many-body theory to the radiation that makes atoms decay and shifts their energy levels.

15 units · 135 lessons · 135 interactive models
A suggested 15-week pathway after Quantum Mechanics II; Units 14–15 are optional extensions.

Before you begin

Bring the tools. Build the new theory.

Readiness questions

  • Can you calculate a perturbative energy shift, a golden-rule rate and a partial-wave scattering amplitude?
  • Can you use density matrices, angular-momentum coupling and noncommuting operators?
  • Can you transform a four-vector and work with Lagrangians, electromagnetic potentials and Fourier modes?
Return to Quantum Mechanics II →
Complete prerequisites
  • University Quantum Mechanics II or equivalent: perturbation theory, Fermi's golden rule, partial waves and the Born approximation, density operators and Clebsch-Gordan coupling, used here without being re-taught, and its accounts of fine structure, the Lamb shift, radiative rates and identical particles, whose quoted results this course derives
  • Classical mechanics through Lagrangians, Hamiltonians and the normal modes of coupled oscillators, and statistical mechanics through the canonical ensemble and the Fermi-Dirac and Bose-Einstein distributions
  • Electromagnetism with Maxwell's equations in terms of potentials, gauge transformations including the Coulomb gauge, the energy and momentum carried by the field, and boundary conditions at conductors
  • Special relativity in four-vector form: Lorentz transformations as matrices, four-momentum with E² = p² c² + m² c⁴, and the transformation of electric and magnetic fields
  • Linear algebra with matrix exponentials, traces and anticommuting matrices, Fourier analysis in three and four dimensions, series solutions of differential equations, and complex analysis to contour integrals and principal values
  • Enough programming, for example Python with NumPy and SciPy, to iterate a self-consistent field, sum over a discretised continuum and integrate coupled or stochastic equations

Where the course leads

Units 1–2 establish symmetry and spin scattering. Units 3–8 develop relativistic one-particle theory and its limits. Units 9–13 build free fields, many-body operators and Coulomb-gauge radiation. Units 14–15 extend into open systems and quantum gases.

This course stops before interacting covariant QED, systematic Feynman-diagram perturbation theory and a general renormalisation programme.

See the Quantum Field Theory I pathway →

A course map you can use

Fifteen units. A clear next step in each.

Start with the unit orientation, then follow its nine lessons. A week per unit is a planning suggestion; the final two units can be trimmed for a shorter term. After Unit 8 is a suggested midterm checkpoint.

Unit 01 · Course sequence

Discrete Symmetries: Parity, Time Reversal and Kramers Degeneracy

A symmetry preserves transition probabilities, but it need not act linearly on state vectors. Time reversal conjugates complex coefficients as well as reversing angular momentum. That extra conjugation controls the sign of its square and, with an invariant Hamiltonian, protects Kramers pairs.

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Nine lessons and complete unit specification
  1. Wigner's theorem: every symmetry is unitary or antiunitary
  2. Antiunitary operators: antilinearity, complex conjugation K and transformed operators
  3. Parity as a unitary symmetry, and what a parity-odd term in H does
  4. Why time reversal must be antiunitary
  5. Time reversal for a spinless particle: Θ = K and real wavefunctions
  6. Time reversal with spin: Θ = exp(−i π Jy/ℏ) K and Θ² = (−1)(2j)
  7. Kramers degeneracy derived
  8. Permanent electric dipole moments violate both P and T
  9. Time reversal in scattering: reciprocity and detailed balance

Unit overview

The symmetry tools the rest of the course needs, built before any relativity. Wigner's theorem, outlined with Bargmann's proof quoted, makes every symmetry unitary or antiunitary, and only a discrete one can be antiunitary. Parity is unitary and sorts operators into polar and axial vectors, scalars and pseudoscalars; time reversal is shown to be antiunitary, constructed for spinless particles and for spin, and found to square to −1 for half-integer j whatever phase is chosen. Kramers degeneracy, quenched moments in non-degenerate states, the violation of both P and T by a permanent electric dipole moment, and reciprocity and detailed balance in scattering follow as theorems, their assumptions stated. Rotations, the Wigner-Eckart theorem and parity selection rules are used from Quantum Mechanics II, not re-taught; charge conjugation and time reversal for Dirac spinors wait for Unit 8.

Prerequisites

  • Rotation operators exp(−i J . n-hat φ/ℏ) generated by J, the sign a spin-half acquires under 2 π, and the standard |j, m⟩ basis in which Jₓ and Jz are real and Jy imaginary
  • Vector operators, the Wigner-Eckart and projection theorems, and the parity (−1)l of Yₗm with the dipole selection rules it supports
  • Spin and orbital magnetic moments in a field, and hydrogen's Stark effect: quadratic for 1s, linear for the degenerate n = 2 levels until the Lamb shift intervenes
  • Non-degenerate and degenerate perturbation theory to second order
  • Scattering of a spinless particle: the amplitude f, the Lippmann-Schwinger equation with its outgoing-wave condition, and cross-sections from |f|²
  • Linear algebra over the complex numbers, including the difference between linear and antilinear maps and the matrix of an operator in a chosen basis

Learning outcomes

  • Show that a symmetry continuously connected to the identity must be unitary, and state what Wigner's theorem asserts and which part of its proof is quoted.
  • Construct the time-reversal operator for a spinless particle and for spin j, find its action on x, p, L, S and |j, m⟩, and prove that Θ² = (−1)(2j) whatever phase is chosen.
  • Classify an operator or a Hamiltonian term as even or odd under P and under T, and use the classification to show which expectation values and matrix elements must vanish.
  • Derive Kramers degeneracy and decide, for a given system in given applied fields, whether its levels must stay paired and whether its magnetic moment can be quenched.
  • Prove that a permanent electric dipole moment in a non-degenerate multiplet of a rotation-invariant system requires both P and T to fail, and explain why hydrogen's linear Stark effect and the dipoles of polar molecules do not contradict this.
  • Derive reciprocity and detailed balance for a time-reversal-invariant interaction, and use detailed balance to infer a particle's spin from a reaction and its inverse.

Investigations

Kramers doublets and quenched singlets in a crystal field

For the ground multiplets of Ce3+ (4f¹, J = 5/2) and Pr3+ (4f², J = 4), does every crystal-field Hamiltonian that commutes with Θ leave exact doublets for J = 5/2 and, at a site of no symmetry, generically only singlets for J = 4, and do those singlets carry zero magnetic moment, so that a weak magnetic field moves them quadratically while it splits each doublet linearly?

Theta built as exp(−i pi Jy/ℏ) K in each multiplet and checked to square to −1 and +1; a few hundred crystal fields per multiplet drawn at random by symmetrising Hermitian matrices under Theta; the splitting within each J = 5/2 doublet at the level of rounding error, and no residual degeneracy for J = 4; ⟨J⟩ in every J = 4 singlet zero to rounding; Zeeman shifts plotted against B on log-log axes with fitted slopes near 1 for the doublets and 2 for the singlets; and a random T-odd term shown to split every doublet while added T-even terms of any size never do, so that the pairing is traced to Θ² = −1 and not to the form of the field.

Reciprocal and non-reciprocal rotation of polarisation: a sugar solution against a Faraday rotator

Does the rotation of linear polarisation cancel on a double pass through a sucrose solution and double on a double pass through a glass rod inside a solenoid, as reciprocity, the classical-field counterpart of topic 1.09, predicts for a medium even under T and fails to predict once a magnetic field, odd under T, acts?

Rotation angles read with a polariser and analyser, the double pass made with a mirror and a non-polarising beam splitter and the empty path measured as a control for the splitter's own polarisation effects; single-pass rotation against concentration times path length for the solution and against coil current, with the field calibrated by a Hall probe, for the rod; the fitted specific rotation and Verdet constant with uncertainties; double-to-single-pass ratios compared with the predicted 0 and 2; the sign change of the Faraday rotation when the current reverses; and a statement of why the chiral solution responds as a pseudoscalar, odd under P but even under T, without any law of physics violating parity.

Practice focus

Fixing the P and T signature of every operator and term before calculating, carrying each complex conjugate through every antiunitary step, and naming for each theorem the assumption that does the work: Θ² = −1, non-degeneracy, rotation invariance or the time-reversal invariance of the interaction

Take Ce3+, whose 4f¹ ground multiplet has J = 5/2, at a crystal site with no point symmetry at all. Construct Theta as a 6 x 6 matrix, verify Θ² = −1, and prove that any crystal field leaves three Kramers doublets, that an applied electric field of any strength can shift a doublet but never split it, and that a weak magnetic field, odd under T, is free to split each doublet linearly. Decide whether a doublet that shifts linearly with the applied electric field signals a violation of T, and if not, which assumption of the electric-dipole theorem the crystal site removes. Then repeat the analysis for Pr3+, with J = 4, saying which conclusions change, and for each conclusion state whether it rested on Θ², on rotation invariance or on the form of the crystal field.

Unit 02 · Course sequence

Scattering with Spin and Identical Particles

Indistinguishable alternatives interfere before probabilities are formed. Spin determines which spatial exchange symmetry is allowed. An unpolarised spin-half pair combines a singlet channel and three triplet channels; adding classical probabilities too early loses the exchange effect.

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Nine lessons and complete unit specification
  1. The spin-dependent amplitude g(θ) + i h(θ) sigma . n
  2. Partial waves with spin: phase shifts for j = l plus or minus 1/2
  3. Polarisation by scattering, and analysing power equal to it by time reversal
  4. Singlet and triplet weights: neutron-proton scattering at low energy
  5. Identical bosons: the symmetrised amplitude f(θ) + f(π - θ)
  6. Identical spin-half fermions: (1/4)|f + f'|² + (3/4)|f - f'|²
  7. The exact Coulomb amplitude in parabolic coordinates
  8. Mott's formulas for identical charged particles
  9. Absorption and inelastic channels: the optical theorem in general

Unit overview

Quantum Mechanics II's scattering theory extended to the two cases it set aside, its own stated next step. For a spin-half projectile on a spinless target, rotation and parity reduce the amplitude to g + i h sigma . n; partial waves split by j, an unpolarised beam emerges polarised, and the analysing power equals that polarisation, by Unit 1's reciprocity in general. Spin-dependent forces weight singlet and triplet 1/4 and 3/4, which with quoted scattering lengths accounts for low-energy neutron-proton scattering. Identical particles scatter with symmetrised amplitudes, and with the Coulomb amplitude derived exactly in parabolic coordinates Mott's 1930 formulas follow. Partial-wave unitarity with absorption gives the optical theorem with inelastic channels that Quantum Mechanics II quoted. All it derives is non-relativistic; the relativistic Mott factor waits for Unit 5.

Prerequisites

  • Partial waves for a spinless particle: f(θ) = (1/k) sum (2l + 1) exp(i δₗ) sin(δₗ) Pₗ(cos θ), the unitarity limit, the scattering length and the elastic optical theorem
  • The first Born approximation and Rutherford's cross-section from the screened Coulomb potential, and Kummer's equation with the quoted large-argument form of its regular solution, from hydrogen's radial problem
  • Coupled states |l, 1/2, j, mⱼ> with L . S equal to l ℏ²/2 and -(l + 1) ℏ²/2, and the triplet and singlet with S₁ . S₂ equal to ℏ²/4 and −3 ℏ²/4
  • The spin-half density matrix (1 + P . σ)/2, its polarisation vector P, and expectation values as traces of Pauli-matrix products
  • The symmetrisation postulate, the pairing of a symmetric spatial state with the singlet and an antisymmetric one with the triplet, and the boson or fermion character of composites such as the alpha particle
  • Unit 1's antiunitary time reversal with Theta S Θ⁻¹ = −S, and the reciprocity relation it gives between a scattering amplitude and the time-reversed process

Learning outcomes

  • Derive the form g + i h sigma . n of a spin-half amplitude on a spinless target from rotation and parity invariance, and express g and h through the phase shifts of j = l plus or minus 1/2.
  • Compute from given g and h the polarisation an unpolarised beam acquires and the left-right asymmetry of a polarised one, and explain why the two are equal, by the form of the amplitude and by reciprocity.
  • Write a spin-dependent amplitude with singlet and triplet projectors and reproduce the 20.4 barns of low-energy neutron-proton scattering from the two scattering lengths, showing that neither alone suffices.
  • Build symmetrised amplitudes for identical bosons and fermions of any spin, say which partial waves survive, and count events so that a total cross-section is not counted twice.
  • Derive the exact Coulomb amplitude in parabolic coordinates and Mott's formulas, and predict the angular period of the interference near 90 degrees and how the classical limit emerges as eta grows.
  • Compute elastic, reaction and total cross-sections from phase shifts and inelasticities, verify the optical theorem with absorption, and derive the black disc's pi R² each of absorption and shadow scattering.

Investigations

Polarisation by a spin-orbit potential: partial waves for j = l plus or minus 1/2

For neutrons on a spin-zero nucleus described by a Woods-Saxon central potential with a Thomas-form spin-orbit term of realistic strength, at what energy and angle is the scattered beam most strongly polarised, and does P vanish, as this unit predicts, when only s waves contribute, when the spin-orbit term is switched off, and in the first Born approximation?

Radial equations integrated by Numerov's method for each l and j = l plus or minus 1/2 up to an lₘₐₓ of about kR + 5, with phase shifts converged in step size, matching radius and lₘₐₓ; g, h, d σ/d Omega and P(θ) at several energies; a map of P against energy and angle with its maximum located; the three null checks carried out; the elastic optical theorem σ = (4 π/k) Im g(0) verified to better than 0.1 per cent; and, with an imaginary central term added, the reaction cross-section computed and the optical theorem with absorption checked.

Mott interference for identical charged particles and the approach to the classical limit

Near 90 degrees, how fast does the visibility of Mott's interference fall as eta grows for a detector of fixed angular resolution, does it follow the exp(−2 η² s²) suppression that a Gaussian acceptance of width s radians predicts, and does the averaged cross-section then approach the classical sum of the two Rutherford terms for both spinless bosons and unpolarised spin-half fermions?

Mott cross-sections divided by the classical sum, computed for spin-zero and unpolarised spin-half particles from 30 to 150 degrees for eta from 0.1 to 100; the oscillation period near 90 degrees fitted and compared with π/η; the exact 90-degree ratios of 2 and 1/2, independent of η, checked; the cross-sections convolved with Gaussian acceptances of 0.2 to 2 degrees and the fringe visibility plotted on a log scale against eta s with the predicted exponent tested; and eta computed for α-α, carbon-12 on carbon-12 and proton-proton at stated energies to say which experiments could resolve the fringes.

Practice focus

Constructing amplitudes from rotation, parity and time-reversal invariance, carrying spin through scattering with Pauli-matrix traces and density matrices, symmetrising identical-particle amplitudes and counting events so nothing is counted twice, and saying of each result whether it was derived here or quoted, as the Kummer asymptotics, the scattering lengths and the Sherman function are

For proton-proton scattering at a few MeV, write the amplitude as the exact Coulomb amplitude plus the s-wave nuclear term (1/k) exp(2i σ₀) exp(i δ₀) sin(δ₀), its form and the Coulomb-modified phase shift δ₀ given, symmetrise it with singlet and triplet weights, and show that the nuclear term enters the singlet only. Compute d σ/d Omega at 90 degrees relative to Mott's pure-Coulomb value for an unpolarised beam and target, then for beam and target fully polarised parallel, and explain why in this model the second measurement sees neither the nuclear force nor any scattering at 90 degrees. Then estimate eta at 3 MeV to judge whether Mott's oscillations could be resolved, and state which ingredients were derived in this unit and which were quoted.

Unit 03 · Course sequence

The Klein-Gordon Equation

Relativistic dispersion does not automatically supply a probability interpretation. The Klein–Gordon equation has a conserved current, but its time component can be locally negative. Positive-energy interference exposes this distinction between a wave equation and a one-particle probability model.

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Nine lessons and complete unit specification
  1. Covariant notation and the Klein-Gordon equation
  2. The conserved Klein-Gordon current and its indefinite density
  3. The non-relativistic limit: Schrodinger plus −p⁴/(8 m³ c²)
  4. Minimal coupling and gauge invariance of the Klein-Gordon equation
  5. A spinless particle in a uniform magnetic field: relativistic Landau levels
  6. The Klein-Gordon equation in a Coulomb field: the radial equation
  7. Exact Klein-Gordon Coulomb levels: wrong for hydrogen, right for pionic atoms
  8. Fall to the centre: Z alpha above l + 1/2
  9. Why the Klein-Gordon equation is not a one-particle wave equation

Unit overview

The first relativistic wave equation, solved exactly and then shown to fail as a one-particle theory. Covariant notation and pμ = i ℏ dμ are fixed for the whole course, and the Klein-Gordon equation follows from pμ pμ = m² c2. Its conserved current has an indefinite density; its non-relativistic limit gives Schrodinger's equation plus the −p⁴/(8 m³ c²) term Quantum Mechanics II found by expanding the energy; minimal coupling adds fields, solved exactly for a uniform magnetic field. In a Coulomb field Quantum Mechanics II's series, run with non-integer l', gives exact levels depending on n and l: wrong for hydrogen at order α⁴ by the spin-orbit and Darwin terms, right for spinless pionic atoms, whose data are quoted, and without a ground state for a point nucleus once Z alpha exceeds 1/2. Its reading as a field of particles and antiparticles waits for Unit 9.

Prerequisites

  • Special relativity in four-vector form: Lorentz transformations, the invariant E²/c² - p² = m² c², and the cyclotron frequency |q|B/(γ m) of a relativistic charge
  • Hydrogen's radial equation solved by series: u = rR, behaviour factored off at the origin and at infinity, and the recursion for v(ρ) and its termination at ρ₀ = 2(nᵣ + l + 1), steps that nowhere need l to be an integer, although discarding the second solution at the origin did
  • Minimal coupling H = (p - qA)²/2m + q times the scalar potential, the gauge transformation that multiplies ψ by exp(iq Λ/ℏ), and Landau levels solved in the Landau gauge
  • Hydrogen's fine structure: the kinetic correction −p⁴/(8 m³ c²) and its expectation value, the spin-orbit term with its quoted Thomas factor and the quoted Darwin term, Eₙⱼ depending on n and j alone, and the quoted Dirac energy with its α⁴ expansion
  • Probability density, current and the continuity equation, and plane waves and wave packets built by Fourier transforms, from Quantum Mechanics I

Learning outcomes

  • Derive the Klein-Gordon equation from pμ pμ = m² c² with pμ = i ℏ dμ, show that it is Lorentz invariant, and find its plane-wave spectrum with both signs of energy.
  • Derive the conserved Klein-Gordon current, show that its density is negative on negative-energy waves and can be given either sign by the initial data, and explain why it cannot be a probability density.
  • Recover the Schrodinger equation and the −p⁴/(8 m³ c²) correction from the Klein-Gordon equation, free and in a static potential, and state the conditions under which the limit holds.
  • Solve the minimally coupled Klein-Gordon equation exactly in a uniform magnetic field and in a Coulomb potential by mapping each onto a problem Quantum Mechanics II solved, naming every parameter that changes.
  • Expand the exact Klein-Gordon Coulomb energies to order (Z α)⁴, assign their disagreement with hydrogen state by state to the missing spin-orbit and Darwin terms, and identify pionic atoms as the system they do describe.
  • Find, for each l, the Z alpha beyond which the point-Coulomb solutions oscillate infinitely often near the origin and the energy formula turns complex, and list the three independent reasons the equation fails as a one-particle wave equation.

Investigations

Klein-Gordon levels from a point nucleus to a finite one, through Z α = 1/2

Does a numerical solution of the Klein-Gordon radial equation for a spinless particle of the electron's mass reproduce the exact point-Coulomb 1s, 2s and 2p energies at small Z, and as Z alpha passes 1/2, where the point-nucleus 1s formula turns complex, does a uniformly charged nucleus of radius 1.2 A¹⁄³ fm give a real 1s energy, and how strongly does that energy then depend on the radius?

A shooting or finite-difference radial solver that handles the quadratic dependence on E by iterating on the energy, checked against the exact formula to at least six figures for Z from 1 to 60 with the nuclear radius taken to zero; the finite-nucleus 1s energy for Z up to 92 beside the point formula; the fractional change of the 1s binding when the radius is doubled, plotted against Z and compared below and above Z α = 1/2; and the computed wavefunction near the nucleus on either side of that value.

Negative frequencies in a narrow Klein-Gordon wave packet

If a one-dimensional Gaussian packet of rms width w is started with d φ/dt = −i(mc²/ℏ) φ, as the non-relativistic picture suggests, what fraction of its conserved charge sits in negative frequencies, does that fraction fall as (ℏ/mcw)⁴ for wide packets with the coefficient an expansion by hand predicts, and below what width does it exceed 1 per cent?

Each Fourier mode split into positive- and negative-frequency amplitudes from phi and d φ/dt at t = 0; the negative-frequency fraction of the charge against w/(ℏ/mc) on log-log axes with fitted slope and coefficient set beside the hand expansion; the density evolved exactly mode by mode, showing the interference at about 2mc²/ℏ that Unit 8 meets as Zitterbewegung; and the most negative local density reached by a packet built from positive frequencies alone as w shrinks.

Practice focus

Moving between covariant and three-vector forms without sign errors, mapping each Klein-Gordon problem onto a Schrodinger problem already solved, and checking every exact result against its non-relativistic limit and against the hydrogen data it fails to fit

For n = 2 and n = 3 of a spinless particle bound to a point nucleus of charge Z, compute the exact Klein-Gordon energies, expand them to order (Z α)⁴, and show that the term equals the expectation value of −p⁴/(8 m³ c²). Set the n = 2 pattern beside hydrogen's and assign the difference, state by state, to the spin-orbit and Darwin terms of Quantum Mechanics II's fine structure. Then find the Z at which the 1s and 2p formulas fail, say what a finite nucleus changes, and say which results of the unit survive when Unit 9 rereads the equation as a field equation and which do not.

Unit 04 · Course sequence

The Dirac Equation and Its Free Solutions

Dirac replaces a second-order time equation with a first-order spinor equation. Anticommuting matrices make its square reproduce relativistic energy, while the spinor current has a positive density. Four components encode more structure than two independent spin states, and positive density alone does not resolve negative-energy solutions.

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Nine lessons and complete unit specification
  1. Dirac's requirements and the algebra of alpha and beta
  2. Why four components: the Dirac representation constructed
  3. Gamma matrices, the Clifford algebra and trace identities
  4. The conserved current and its positive density
  5. Solutions at rest: two of positive energy and two of negative
  6. Plane-wave spinors u(p, s) and v(p, s) at any momentum
  7. Spin from the equation: L is not conserved, J = L + (ℏ/2) Σ is
  8. Helicity, energy projectors and spin sums
  9. Minimal coupling and the gauge invariance of the Dirac equation

Unit overview

Dirac's equation built from his requirements rather than postulated, as Unit 3's failures demand. An equation first order in time and in space, with a positive conserved density and every component obeying the Klein-Gordon equation, forces four Hermitian matrices that square to 1 and anticommute, so psi has at least four components; the Dirac and Weyl representations, the γ-matrix algebra with its trace identities and the conserved current follow, all derived. Free solutions are built and normalised at rest and at any momentum; two have negative energy and cannot be discarded, their meaning left to Unit 8. Commutators show that L is not conserved but J = L + (ℏ/2) Σ is, so the equation itself describes spin one-half, and helicity, energy projectors, spin sums and minimal coupling close the unit. Covariance is assumed until Unit 5 proves it, and g = 2 waits for Unit 6.

Prerequisites

  • The Klein-Gordon equation of Unit 3: xμ = (ct, x), the metric diag(1, −1, −1, −1), pμ = i ℏ dμ, plane waves of both energy signs, and why a second time derivative makes its density indefinite
  • The Pauli matrices with σᵢ σⱼ = δᵢⱼ + i εᵢⱼₖ σₖ, the spin operators S = (ℏ/2) σ, and the eigenspinors of σ . n-hat along any axis
  • Angular momentum as the generator of rotations: [Jᵢ, Jⱼ] = i ℏ εᵢⱼₖ Jₖ, conservation of J under a rotation-invariant H, and the spin-half rotation exp(−i σ . n-hat φ/2) with its sign under 2 pi
  • Operator dynamics in the Heisenberg picture: dA/dt = (i/ℏ)[H, A], conserved quantities as operators commuting with H, and the velocity operator (p - qA)/m read from i[H, r]/ℏ
  • Minimal coupling, p replaced by p - qA with q times the scalar potential added, and the gauge phase exp(iq Λ/ℏ) that keeps a wave equation's form, as Quantum Mechanics II and Unit 3 applied them
  • Matrix algebra: Hermitian and unitary matrices, traces and their cyclic property, the eigenvalues of a matrix that squares to the identity, similarity transformations and 2 x 2 block multiplication

Learning outcomes

  • Derive from Dirac's requirements that αᵢ and beta are Hermitian, square to 1 and anticommute in pairs, and prove that they must be at least 4 x 4.
  • Construct the Dirac and Weyl representations, verify {γμ, γν} = 2 g(μ ν) in each and the unitary that joins them, and evaluate traces of up to four γ matrices from the algebra alone.
  • Derive the conserved current with its positive density, and explain why positivity, though it removes Unit 3's objection, leaves the negative-energy solutions in place.
  • Construct and normalise u(p, s) and v(p, s) at any momentum, recover the rest spinors as p goes to 0, and show that the positive-energy spinors alone are not complete.
  • Show by commutators that J = L + (ℏ/2) Σ and the helicity are conserved for a free particle while L and Σ are not, and use the energy projectors and spin sums to turn a sum over unobserved spins into a trace.
  • Couple the equation minimally to an electromagnetic field, verify its gauge invariance and compute its velocity operator, stating which results of the unit are derived and which, covariance and the meaning of negative energies, wait for Units 5 and 8.

Investigations

How small is the small component? Numerical Dirac spinors against the analytic ones

Do eigenvectors of the 4 x 4 free Dirac Hamiltonian, diagonalised numerically for speeds from 0.01c to 0.999c, reproduce the analytic u and v spinors, their normalisation and the spin sums p-slash plus or minus mc, and at what speed does the ratio of small to large components first exceed the low-speed estimate v/2c by 10 per cent, and at what speed does it reach one half?

Eigenvalues against |p| showing two doubly degenerate branches at plus and minus √(p² c² + m² c⁴), a comparison made through the projectors onto each degenerate pair rather than through individual eigenvectors, which a solver may mix arbitrarily within a pair, v(p, s) read from the negative-energy eigenvectors of H at momentum −p, since those of H at p are v(−p, s) and give u-bar v nonzero, residuals of u-bar u = 2mc, u-bar v = 0 and both spin sums at machine precision, and the numerical component ratio plotted against v/c beside v/2c and the closed form γ v/((γ + 1) c), with the two crossing speeds read off and checked against that closed form.

Searching for anticommuting matrices: is four the minimum, and which sizes work?

Can a numerical minimiser find four Hermitian N x N matrices that square to the identity and anticommute in pairs for N = 2, 3, 4, 5, 6 and 8, does it succeed only where topic 4.02's trace and Pauli-counting arguments allow, and is N = 6, which those arguments do not exclude, also impossible?

The residual of the algebra minimised from many random starts for each N, the smallest final residual plotted against N with zero reached only at N = 4 and 8, the nonzero floor at N = 6 explained by the quoted result that every representation is a direct sum of four-dimensional ones, a solution found at N = 4 carried into the Dirac representation by a similarity matrix built by summing over the sixteen products of gammas and checked, once normalised, to be unitary, and topic 4.03's trace identities evaluated in both representations to machine precision.

Practice focus

Building spinors and operator identities from the anticommutation algebra alone, checking each in a second representation or against the rest frame, and saying at each step what is derived here and what, covariance and the meaning of negative energies, is deferred to Units 5 and 8

For an electron moving along z at v = 0.8c, so that E = (5/3) mc² and p = (4/3) mc, construct u and v spinors of both helicities in the Dirac representation, normalise them to 2E/c, and verify u-bar v = 0, the energy projectors and the spin sums against p-slash plus or minus mc. Transform them to the Weyl representation and show that the density, the current and the helicity are unchanged though the components are not. Then compute <c αz> in a positive-energy plane wave, compare it with the group velocity p c²/E, and explain why this agreement does not remove the puzzle that c αz has eigenvalues plus and minus c, naming the unit that resolves it.

Unit 05 · Course sequence

Lorentz Covariance of the Dirac Equation

A Dirac spinor and a four-vector transform differently, even though each has four components. Covariance links their transformations through the gamma matrices. Spinor boosts need not preserve the ordinary component norm; the Dirac adjoint instead makes scalar and current bilinears transform correctly.

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Nine lessons and complete unit specification
  1. Lorentz transformations and their generators: rotations J and boosts K
  2. The covariance condition S⁻¹ γμ S = Λμν γν
  3. Infinitesimal transformations and the generators σ(μ ν)
  4. Finite rotations and boosts: half angles, the sign under 2 pi and non-unitary boosts
  5. ψ-bar and the sixteen bilinear covariants
  6. Parity for Dirac spinors: SP = γ⁰, and scalars against pseudoscalars
  7. The Gordon decomposition: a g = 2 moment in the free current
  8. γ⁵, chirality and the massless Weyl equations
  9. Coulomb scattering of a Dirac electron: spin sums, traces and the Mott factor

Unit overview

The proof that Dirac's equation holds in every inertial frame, and what follows. The Lorentz generators are found from 4 x 4 matrices as Quantum Mechanics II found the rotation algebra, and two non-collinear boosts leave a rotation, the origin of Unit 6's Thomas precession. Covariance reduces to one condition on a spinor matrix S(Λ), solved for infinitesimal and finite transformations: spinors transform with half angles, change sign under 2 π, and boost by a non-unitary matrix that turns Unit 4's rest spinors into u and v. The sixteen bilinears are classified under proper transformations and parity, SP = γ⁰ is derived, the Gordon decomposition finds a g = 2 moment in the free current, γ⁵ gives chirality and the Weyl equations, and Mott's factor 1 - β² sin²(θ/2) follows by traces. Pauli's fundamental theorem and Mott's exact solution are quoted.

Prerequisites

  • The Dirac equation in covariant form, (i ℏ γμ dμ - mc) ψ = 0, with the Clifford algebra {γμ, γν} = 2 g(μ ν), the Dirac and Weyl representations, and the trace identities for two and four gammas
  • The free spinors u(p, s) and v(p, s) normalised to u-dagger u = 2E/c, the energy projectors and the spin sums equal to p-slash plus or minus mc, and helicity Σ . p-hat
  • Four-vector notation with xμ = (ct, x) and the metric diag(1, −1, −1, −1): raising and lowering indices, invariants such as pμ pμ = m² c², and a boost along one axis written as a 4 x 4 matrix
  • Rotation operators as exponentials of generators whose commutators follow from multiplying rotation matrices, and the spin-half rotation cos(φ/2) - i sigma . n-hat sin(φ/2) with its sign under 2 pi
  • Parity as a unitary symmetry, and operators sorted into scalars, pseudoscalars, polar vectors and axial vectors
  • The first Born approximation and its agreement with the golden rule, and Rutherford's cross-section as the Born result for a Coulomb potential

Learning outcomes

  • Derive the commutators of the Lorentz generators from 4 x 4 matrices, and show that two perpendicular boosts compose into a boost and a rotation through about v₁ v₂/(2c²) at low speed.
  • Construct S(Λ) from the covariance condition for infinitesimal and finite rotations and boosts, and verify that boosting Unit 4's rest spinors gives u(p, s) and v(p, s) with the right normalisation.
  • Classify the sixteen bilinear covariants under proper Lorentz transformations and under parity, and name the pairs that only parity can tell apart.
  • Derive the Gordon decomposition of the free current and identify its spin term as the current of a magnetisation with g = 2.
  • Project a Dirac spinor onto definite chirality, derive the Weyl equations, and explain why chirality equals helicity only for a massless particle and why a vector coupling preserves it.
  • Compute the spin-averaged Coulomb cross-section of a Dirac electron with spin sums and traces, and explain from helicity and angular momentum why backward scattering vanishes as beta tends to 1.

Investigations

Spinor boosts and the Wigner rotation, checked numerically

Does an explicitly constructed S(Λ) satisfy the covariance condition to machine precision for random rotations and boosts, does the product of the S matrices for two transformations equal the S of their product only up to a sign, and for two perpendicular boosts does the leftover rotation match the closed-form Wigner angle and approach v₁ v₂/(2c²) at low speed?

Gamma matrices built in the Dirac and Weyl representations and checked against the Clifford algebra, residuals of S⁻¹ γμ S - Λμν γν for a few thousand random transformations, the sign of S(Λ₁) S(Λ₂) S(Λ₁ Λ₂)⁻¹, each S built from the principal rotation angle and rapidity of its Λ, recorded for random pairs and for rotations whose angles sum past 2 π, the rotation extracted from a composed boost by polar decomposition with its angle plotted against v₁ v₂/c² and the small-velocity slope fitted, and boosted rest spinors compared component by component with u(p, s) and v(p, s).

Helicity amplitudes for Coulomb scattering of a Dirac electron

Computed from explicit spinors, do the four helicity amplitudes for Coulomb scattering split into a non-flip part proportional to cos(θ/2) and a flip part proportional to (mc²/E) sin(θ/2), and does their spin-averaged sum reproduce the trace result 1 - β² sin²(θ/2) at every angle and energy?

Helicity spinors built from Unit 4's u(p, s) for the incoming and outgoing directions, the matrix elements u-dagger(p', h') u(p, h) tabulated for theta from 0 to 180 degrees and E/mc² from 1 to 100, agreement with the trace formula to rounding error, the flip contribution relative to Rutherford at 90 and 180 degrees plotted against E/mc² on log-log axes with its slope of −2 fitted, and the Mott factor plotted against theta for several β, showing the backward zero as beta tends to 1.

Practice focus

Constructing S(Λ) explicitly rather than appealing to its existence, classifying each bilinear by how it behaves under rotations, boosts and parity, and reducing spin sums to traces, saying at each step whether a result follows from the Clifford algebra alone or is quoted, as Pauli's fundamental theorem and Mott's exact solution are

Boost a spin-up electron at rest along x with S(Λ) and show that the result is Unit 4's u(p, s), with u-bar u unchanged and u-dagger u multiplied by the Lorentz factor gamma. Boost it again along y, find the rotation by which its spin differs from that produced by a single boost to the same final momentum, and compare it with v₁ v₂/(2c²) at low speed. Then compute the spin-averaged cross-section for Coulomb scattering by traces, split it into helicity-preserving and helicity-flipping parts, and explain why backward scattering vanishes as beta tends to 1, saying which steps used only the Clifford algebra and which used the Born approximation.

Unit 06 · Course sequence

The Non-Relativistic Limit: g = 2, Spin-Orbit Coupling and the Darwin Term

At low energies, the Dirac equation yields the Pauli Hamiltonian and fine structure. The Foldy–Wouthuysen transformation preserves the norm and Hermiticity while producing kinetic, spin–orbit and Darwin corrections together. Minimal coupling fixes the electron spin factor at g = 2; its measured excess requires additional physics.

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Nine lessons and complete unit specification
  1. Large and small components: eliminating chi to order v/c
  2. The Pauli equation and g = 2 from minimal coupling
  3. Exact Landau levels of a Dirac electron: g = 2 as an exact degeneracy
  4. Anomalous moments: Pauli's term, g = 2(1 + a) and how g - 2 is measured
  5. Why naive elimination fails at order (v/c)²
  6. The Foldy-Wouthuysen transformation to order (v/c)²
  7. Spin-orbit coupling with the Thomas factor built in
  8. The Darwin term from the double commutator [O, [O, q phi]]
  9. Thomas precession derived from non-commuting boosts

Unit overview

Results Quantum Mechanics II quoted from the Dirac equation, here derived from it. Eliminating the small component of Unit 4's minimally coupled equation gives the Pauli equation, whose spin term has g = 2 exactly, and the exact Landau levels of a Dirac electron show g = 2 as a degeneracy that Pauli's anomalous-moment term breaks, the splitting Penning traps measure. Naive elimination at order (v/c)² is shown to give a non-Hermitian operator; the Foldy-Wouthuysen transformation then yields the kinetic correction, the spin-orbit operator with the Thomas half built in and the Darwin term, nothing inserted by hand, which with Quantum Mechanics II's expectation values reproduce its n- and j-only energies. Thomas precession is derived independently from Unit 5's boost algebra. Schwinger's a = α/(2 π) and measured moments are quoted; the exact Dirac levels wait for Unit 7.

Prerequisites

  • Unit 4's minimally coupled Dirac Hamiltonian H = c α . (p - qA) + β mc² + V in the Dirac representation, with alpha and beta written in Pauli blocks, and its positive density ψ-dagger psi
  • Pauli-matrix algebra: σᵢ σⱼ = δᵢⱼ + i εᵢⱼₖ σₖ, and (σ . a)(σ . b) = a . b + i sigma . (a x b) for vectors whose components commute
  • Minimal coupling without relativity: the mechanical momentum π = p - qA with [πₓ, πy] = i ℏ q Bz, gauge invariance, Landau levels in the Landau gauge, and Unit 3's spinless relativistic Landau levels
  • Lorentz boosts and rotations with their generators, including [Kₓ, Ky] = −i Jz from Unit 5, and the g = 2 moment the Gordon decomposition found in the free current
  • Quantum Mechanics II's fine structure: the rest-frame field B = −v x E/c², the kinetic, spin-orbit and Darwin operators as it derived or quoted them, the expectation values <1/r³> and |ψₙ₀₀(0)|², and Eₙⱼ
  • Unitary changes of representation: exp(iS) H exp(−iS) expanded as nested commutators, with the extra term −ℏ dS/dt when S depends on time

Learning outcomes

  • Derive the Pauli Hamiltonian from the minimally coupled Dirac equation by eliminating the small component, showing where the non-commuting components of p - qA produce -(q/m) S . B with g = 2, and estimate the small component's size in hydrogen.
  • Solve for the exact Landau levels of a Dirac electron, identify the degeneracy that holds only for g = 2, and explain how an anomalous moment splits it and how a Penning trap turns that splitting into a measurement of g - 2.
  • Carry out the Foldy-Wouthuysen transformation to order (v/c)², tracing every term of the result to O², O⁴ or the double commutator, and show why elimination without renormalising the large component gives a non-Hermitian operator whose Laplacian term is twice the Darwin term, although its energies agree at this order.
  • Reduce the spin-orbit and Darwin operators to their central-field and Coulomb forms, combine them with Quantum Mechanics II's expectation values into Eₙⱼ, and compute the roughly 68 MHz an anomalous moment adds between 2S(1/2) and 2P(1/2).
  • Derive the Thomas precession rate from the composition of non-collinear boosts, and show that magnetic and kinematic precession combine into a spin-orbit coefficient proportional to g - 1.
  • Separate what the Dirac equation with minimal coupling fixes exactly, g = 2 and the order-(v/c)² Hamiltonian, from what this unit quotes: Schwinger's a = α/(2 π), measured moments and the radiative corrections Unit 13 begins.

Investigations

The Darwin coefficient tested against an exact one-dimensional Dirac spectrum

For a Gaussian well much shallower than mc² in one dimension, where no spin-orbit term exists, does adding the kinetic correction and the Darwin term (ℏ²/(8m² c²)) V'' to the Schrodinger levels shrink the gap to the exact Dirac levels from order (v/c)² to order (v/c)⁴, and does a fitted Darwin coefficient land on 1/8 rather than the 1/4 that unrenormalised elimination gives once its non-Hermitian term is dropped?

Bound-state energies of H = c σₓ p + σz mc² + V(x) from diagonalisation in a plane-wave basis, which avoids the spurious doubled states of naive finite differences, with mc² subtracted on the diagonal before diagonalising; Schrodinger levels and first-order kinetic and Darwin shifts computed on the same basis; residuals for every bound state over at least a decade of c on a log-log plot with fitted slopes; the Darwin coefficient fitted from the order-(v/c)² residual with its uncertainty; the first-order shifts of the full unrenormalised operator, non-Hermitian term included, shown to equal the renormalised ones; and convergence checks in basis size and box length.

Thomas precession by composing boosts around a circular orbit

Does the product of many small boosts, each taken in the particle's current rest frame, carrying it once around a circular orbit converge to a pure boost times a retrograde rotation through 2 π(γ - 1), and above what speed does the low-speed rate (1/(2c²)) a x v fall more than 10 per cent short of the exact one?

4 x 4 Lorentz matrices composed step by step, the residual rotation extracted from the spatial block after removing the final pure boost, its convergence with the number of steps shown, the angle per orbit compared with 2 π(γ - 1) for beta from 0.01 to 0.99 including speeds where it exceeds a full turn, the 10 per cent speed located, and the defining relation ΛT g Λ = g checked to rounding error at the end as a guard against accumulated error.

Practice focus

Reducing the Dirac Hamiltonian to its non-relativistic form by elimination and by the Foldy-Wouthuysen transformation, counting the order in v/c of every term, and saying for each term of the result which step produced it and what Quantum Mechanics II had quoted in its place

Take an electron with anomalous moment a in a static central potential V(r) and a weak uniform magnetic field B. Write its Dirac Hamiltonian with a Pauli term, reduce it by the Foldy-Wouthuysen method to order (v/c)², and identify the kinetic, Zeeman, spin-orbit and Darwin terms with their coefficients written in terms of g. For hydrogen's n = 2 level, evaluate every term with Quantum Mechanics II's expectation values, first with a = 0, showing that 2S(1/2) and 2P(1/2) coincide, then with Schwinger's a, computing how far they separate and comparing that with the measured 1057.8 MHz. Finally rederive the spin-orbit coefficient from the rest-frame field and Thomas precession alone, and say which of your inputs were derived in this course and which were quoted.

Unit 07 · Course sequence

The Dirac Equation in a Central Field and Hydrogen Solved Exactly

A central potential preserves total angular momentum and parity, while a Dirac spinor joins two orbital angular momenta. The label κ records this structure. For a point Coulomb potential, energies depend on n and j, so some opposite-parity states coincide. Identify the assumption creating each degeneracy.

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Nine lessons and complete unit specification
  1. Conserved operators in a central field: J and parity, but not L
  2. The operator K = β(Σ . L + ℏ) and the quantum number kappa
  3. Spinor spherical harmonics and the action of sigma . r-hat
  4. The coupled radial equations for G(r) and F(r)
  5. Behaviour at infinity and at the origin: γ = √(κ² - (Z α)²)
  6. Series solution, termination and the exact Dirac-Coulomb energies
  7. Reading the spectrum: degeneracy in n and j, and hydrogen-like uranium
  8. The ground state: a weak singularity and the size of the small component
  9. Where the point-nucleus Dirac atom ends, and what it omits

Unit overview

The Dirac energies Quantum Mechanics II quoted for hydrogen, derived. In a central electrostatic potential J and the Dirac parity operator commute with H while L does not, and Dirac's operator K = β(Σ . L + ℏ) supplies the label: its eigenvalue −κ ℏ fixes j and parity together. Spinor harmonics built from Quantum Mechanics II's coupled states, exchanged by sigma . r-hat, leave two first-order radial equations. For Coulomb these are solved as Quantum Mechanics II solved the radial equation, the limits at origin and infinity factored off, and termination of the series gives exact energies depending on n and j alone, so 2S(1/2) and 2P(1/2) stay degenerate to all orders. The 1s spinor, hydrogen-like uranium and the end of the point-nucleus theory near Z = 137 follow; the finite-nucleus limit and measured uranium levels are quoted, and what the Dirac atom omits is ranked.

Prerequisites

  • Unit 4's Dirac Hamiltonian c alpha . p + β mc² with minimal coupling, the α, beta and Sigma matrices of the Dirac representation and their anticommutators, and the conservation of J = L + (ℏ/2) Σ for a free particle
  • Unit 5's parity operator SP = γ⁰ for Dirac spinors, and Unit 6's Foldy-Wouthuysen Hamiltonian to order (v/c)², with kinetic, spin-orbit and Darwin terms, whose order-α⁴ energies the exact solution must reproduce
  • Quantum Mechanics II's series solution of the hydrogen radial equation: the behaviour at the origin and at infinity factored off, Kummer's equation, termination giving n = nᵣ + l + 1, and why an unterminated series cannot be normalised
  • The coupled states |l, 1/2, j, mⱼ> built with Clebsch-Gordan coefficients in the Condon-Shortley convention, the eigenvalues of L . S in them, and the parity (−1)l of an orbital state
  • Quantum Mechanics II's fine-structure formula Eₙⱼ, the quoted Dirac energy expanded to order α⁴, and the sizes of hydrogen's Lamb shift, hyperfine splitting and nuclear-size shift
  • Enough programming to integrate two coupled first-order differential equations by shooting and to evaluate gamma functions

Learning outcomes

  • Show which of J, parity, L² and S . L commute with the central-field Dirac Hamiltonian, prove that K = β(Σ . L + ℏ) commutes with it and that K² = J² + ℏ²/4, and give κ, the two orbital labels and the parity of any state, such as 3D(3/2).
  • Separate the Dirac equation in a central potential with spinor spherical harmonics and the action of sigma . r-hat, derive the coupled radial equations for G and F, and recover Quantum Mechanics II's radial equation from them when energies are small beside mc2.
  • Solve the Coulomb radial equations by series, deriving the exponent gamma at the origin, the decay constant at infinity and the termination condition, and from it the exact energies, explaining why nᵣ = 0 occurs only for negative κ and why states of equal n and j coincide.
  • Construct and normalise the 1s spinor and compute, for a hydrogen-like ion of any Z below 137, its energy, the size and probability share of its small component, and the enhancement of its density near the nucleus.
  • Compute exact binding energies and fine-structure splittings of hydrogen-like ions, compare them with the non-relativistic and order-α⁴ values, and state at what Z alpha each approximation, and the point-nucleus theory itself, fails.
  • Rank, with approximate sizes, what the Dirac-Coulomb energies omit for hydrogen, and say which omission splits 2S(1/2) from 2P(1/2) and which later unit computes it.

Investigations

Relativistic doublets: the K-α1 and K-α2 splitting across the periodic table

Does the K-α1-K-α2 splitting, the 2P(3/2)-2P(1/2) energy difference of an L-shell vacancy, follow the exact Dirac n = 2 doublet with Z replaced by Z - s and one screening constant s for every element, while the order-α⁴ formula needs a screening constant that drifts with Z?

Bragg angles of the K-α doublet from the anodes and fluorescence targets available, such as copper, molybdenum and silver, measured in the highest diffraction orders the crystal allows and converted to energies with its stated lattice spacing; each splitting with an uncertainty from the angular resolution; the screening constant solved from each splitting once with the exact Dirac energies and once with the α⁴ formula, both plotted against Z beside tabulated doublets of heavier elements up to uranium, quoted; and a statement of what screening by the other electrons leaves approximate in the comparison.

A finite nucleus: shooting the Dirac radial equations from hydrogen to the supercritical limit

How large is the finite-nuclear-size shift of 1s, 2s and 2p(1/2) in hydrogen-like ions from Z = 1 to 92, by what factor does it exceed Quantum Mechanics II's non-relativistic contact estimate scaled to uranium, and at what Z does a uniformly charged nucleus bring the 1s level down to −mc²?

A shooting or finite-difference solver for topic 7.04's equations, written for the binding energy E - mc² rather than E, validated against the exact point-Coulomb energies to one part in 10⁹ at Z = 1, 50 and 92 and then run with a uniformly charged sphere of radius 1.2 A¹⁄³ fm; at low Z, where the shift falls below that precision (hydrogen's 1s shift is about 3 parts in 10¹⁰ of its binding), the shift computed instead as the first-order expectation value of the sphere's potential minus the point potential in the exact Dirac states, the two methods checked against each other over the range of Z where both resolve it; the three shifts plotted against Z beside the non-relativistic estimate, which grows as Z⁴ times the square of the nuclear radius and misses the r(2 γ - 2) enhancement; the uranium 1s shift set against the quoted 199 eV; the 2p(1/2) shift, nonzero through its s-wave small component, shown growing relative to the 2s shift; and the Z at which 1s reaches −mc², with the extrapolation A = 2.5Z stated as an assumption, set against the quoted value near 172.

Practice focus

Carrying the separation from commuting operators to radial equations without losing a sign convention, solving the Coulomb case by series to the exact energies, and checking each result against its non-relativistic limit and Quantum Mechanics II's order-α⁴ formula

For the n = 2 shell of a hydrogen-like ion of charge Z, list every state by κ with the orbital labels of its upper and lower components and its parity, write its exact energy from the termination condition and show which energies coincide. Construct the 2P(3/2) state, which like 1s is a single term of the series, in closed form and normalise it. Evaluate the 2P(3/2)-2P(1/2) splitting for Z = 1 and Z = 92 and compare each with the order-α⁴ formula. Then say what the Dirac atom leaves out that splits 2S(1/2) from 2P(1/2) in hydrogen, by about how much, and which unit computes it.

Unit 08 · Course sequence

Negative Energies, Hole Theory and Charge Conjugation

Negative-energy solutions expose the limits of fixed-particle Dirac theory. Hole theory historically introduces positive-energy positrons; charge conjugation relates opposite-charge solutions. Pair creation needs variable particle number. Before calculating production probabilities, test energy, momentum and charge conservation: laboratory energy alone cannot establish an allowed reaction.

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Nine lessons and complete unit specification
  1. Negative-energy components and Zitterbewegung
  2. The Klein step: transmission through a step higher than 2mc²
  3. Dirac's sea: filled negative-energy states and the radiative catastrophe
  4. Holes as positrons: charge, energy, momentum and spin derived
  5. Charge conjugation: ψc = i γ² ψ* and the positron wavefunction
  6. The Klein paradox as pair production, and the critical field
  7. Opposite intrinsic parity of fermion and antifermion, and time reversal for spinors
  8. What hole theory cannot do: the case for quantised fields
  9. Midterm consolidation: symmetries, spin scattering and relativistic one-particle theory

Unit overview

The negative-energy solutions deferred since Unit 4, confronted and reinterpreted. A spinor packet confined within ℏ/mc needs both signs of energy, and their interference is the Zitterbewegung behind Unit 4's velocity eigenvalues of plus and minus c; Dirac spinors matched at a step higher than E + mc² are transmitted however high the step, Klein's paradox. Dirac's filled sea blocks radiative collapse and makes a hole a positron, its charge, energy, momentum and spin derived; charge conjugation, ψc = i γ² ψ*, gives its wavefunction, and the Klein current becomes pair creation in fields near 10¹⁸ V/m. Fermion and antifermion get opposite intrinsic parity, time reversal is built for spinors with T² = −1, and CPT is stated. The unit ends with what hole theory cannot do, Unit 9's specification. The midterm falls this week.

Prerequisites

  • Unit 4's free solutions: the spinors u(p, s) and v(p, s), the energy projectors, the positive conserved density ψ-dagger ψ, minimal coupling, and the velocity operator c alpha whose eigenvalues plus and minus c were left unexplained
  • The gamma matrices in the Dirac representation and their anticommutators, with Unit 5's parity matrix SP = γ⁰ and the bilinear covariants
  • Unit 1's antiunitary time reversal: Θ = −i σy K for spin half, Θ² = −1 for half-integer j, and Kramers degeneracy
  • Unit 7's Dirac-Coulomb bound states, and topic 7.09's statement that with a finite nucleus the 1s level reaches −mc² near Z = 172
  • The one-dimensional potential step from Quantum Mechanics I: matching conditions, reflection and transmission counted from probability currents, and phase against group velocity
  • From Quantum Mechanics II: the Heisenberg equation of motion, Pauli exclusion for identical fermions, and the WKB tunnelling exponent

Learning outcomes

  • Solve the free Heisenberg equations for α(t) and x(t), identify the Zitterbewegung term with its frequency and amplitude, and show that it vanishes in a packet built from one sign of energy.
  • Match Dirac spinors at an electrostatic step, compute R and T in each of the three energy regimes, and show how the choice of transmitted momentum decides between R above 1 with T negative and R and T both between 0 and 1.
  • Derive the charge, energy, momentum, spin and helicity of a hole measured from the filled sea, and verify that i γ² ψ* solves the Dirac equation with the opposite charge and carries a negative-energy solution into the hole's positive-energy wavefunction.
  • Reinterpret the Klein current as pair creation, estimate the critical field m² c³/(e ℏ) and the WKB suppression exp(−π Ec/E) for a uniform field, decide whether a given laboratory field can create pairs at a measurable rate, and explain why a nucleus below Z near 172 creates none although the field close to it exceeds Ec.
  • Compute the intrinsic parity of a fermion-antifermion pair and of positronium states from SP = γ⁰, and construct the time-reversal operator for Dirac spinors, showing that it squares to −1.
  • List the failures of hole theory, state for each what a quantised field must supply, and say of each result of the unit whether it was derived in the one-particle theory, read off the filled sea, or quoted.

Investigations

Annihilation radiation from a sealed sodium-22 source: 511 keV, back to back, polarised at right angles

Do the photons from positron annihilation in matter each carry mc² and leave back to back, and does Compton polarimetry find their polarisations perpendicular, as the odd intrinsic parity of the electron-positron singlet derived in topic 8.07 requires?

Two scintillation detectors energy-calibrated on cesium-137's 662 keV line and sodium-22's own 1275 keV line, giving the annihilation-line centroid with its uncertainty against 511.0 keV; the coincidence rate against the angle between the detectors, peaked at 180 degrees with a width compared with the angle the detector faces subtend; and coincidences of photons Compton-scattered by two small scatterers with scattering planes perpendicular and parallel, their ratio compared with the prediction of the quoted Klein-Nishina cross-section once finite solid angles are folded in, a ratio above 1 indicating odd parity and below 1 even. The source is used under the institution's radiation-safety rules.

A Dirac packet at the Klein step, sharp and smoothed

In a one-dimensional simulation, does a Dirac wave packet striking a step higher than E + mc² split with R below 1, as the group-velocity choice predicts, rather than above it, and when the step is spread over a linear ramp of width w does the transmitted fraction fall as exp(−π (mc²/V₀)(mc w/ℏ)), the uniform-field exponent behind the critical field?

A split-operator integration of the two-component Dirac equation with α = σₓ and β = σz, in units ℏ = m = c = 1, checked by norm conservation and by a free packet moving at c² p/E; reflected and transmitted norms for step heights spanning the transmitting, evanescent and Klein regimes, plotted against both stationary formulas; a check that in the Klein regime the transmitted part has E - V₀ below −mc² yet moves away from the step; the logarithm of the transmitted fraction against w, in units of ℏ/mc, for ramps several Compton wavelengths wide, its fitted slope compared with pi mc²/V₀; and a statement that the pair-creation rate itself lies outside any one-particle simulation.

Practice focus

Keeping track of the sign of energy each solution carries, matching Dirac spinors with the conserved current, deriving every symmetry matrix from a γ-matrix identity, and saying of each result whether it belongs to the one-particle theory, to hole theory, or to the quantised fields of Unit 9

An electron of kinetic energy mc² meets an electrostatic step. Find the step heights at which it is transmitted, evanescent, or in the Klein regime; at V₀ = 5mc² compute R and T with both choices of transmitted momentum and say which a time-dependent packet selects. Then reread the result in hole theory: which particles leave the step, in which directions, with what charges, energies and spins, and which wavefunction, obtained with i γ² ψ*, describes the positron. Estimate the field if the step rose over ℏ/mc and over 1 micrometre, with the suppression exp(−π Ec/E) in each case, and list what in your account hole theory leaves inconsistent and which property of Unit 9's quantised fields removes each problem.

Unit 09 · Course sequence

Quantised Free Fields and the Spin-Statistics Connection

Quantised free fields describe modes through creation and annihilation operators. Their algebra must support positive probabilities, energy bounded below and locality. Scalar commutators and Dirac anticommutators meet these requirements. Locality constrains what an intervention changes elsewhere; correlations need not vanish outside the light cone.

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Nine lessons and complete unit specification
  1. Lagrangian field theory: from coupled oscillators to fields, and Noether's theorem
  2. Canonical quantisation of the real Klein-Gordon field
  3. The complex scalar field: antiparticles and the charge operator
  4. Microcausality: [φ(x), φ-dagger(y)] = 0 at spacelike separation
  5. The Dirac field: Lagrangian, conjugate momentum and modes before the algebra is chosen
  6. Quantising the Dirac field with commutators: energy unbounded below
  7. Quantising with anticommutators: positive energy, exclusion and positrons without a sea
  8. The scalar field with anticommutators violates microcausality
  9. The spin-statistics connection: what is shown and what is assumed

Unit overview

The pivot from wave equations to quantised fields, meeting the specification Unit 8 drew up. A Lagrangian density gives field equations and Noether currents, and the real and complex Klein-Gordon fields, quantised canonically, become one oscillator per mode: quanta of positive energy, antiparticles of opposite charge, and a commutator that vanishes outside the light cone although the propagation amplitude does not. The Dirac field is quantised twice: canonical commutators give negative norms or an energy with no lower bound, anticommutators give positive energy, exclusion and positrons without a sea, while a scalar field with anticommutators breaks microcausality. The spin-statistics connection Quantum Mechanics II quoted is thereby derived for free spin-0 and spin-1/2 fields, each assumption stated and the general theorems quoted. The fields are free; interactions begin in Unit 10.

Prerequisites

  • The Klein-Gordon equation in covariant notation, its conserved current with an indefinite density, its negative-frequency solutions, and Pauli and Weisskopf's charge-density reading as Unit 3 stated it
  • Unit 4's plane-wave spinors u(p, s) and v(p, s) with their normalisation and orthogonality, the spin sums of u u-bar and v v-bar equal to p-slash plus or minus mc, and the conserved current ψ-bar γμ psi
  • Hole theory from Unit 8: holes as positrons with derived charge, energy, momentum and spin, charge conjugation relating u and v, and the list of what hole theory cannot do
  • The oscillator by ladder operators from Quantum Mechanics I: [a, a-dagger] = 1, H = ℏ ω (a-dagger a + 1/2), number states, and the norm argument that keeps n non-negative
  • Lagrangian and Hamiltonian mechanics: Hamilton's principle, Euler-Lagrange equations, canonical momenta and the Legendre transform, with normal modes of coupled oscillators and Fourier series in a periodic box
  • Identical particles as Quantum Mechanics II treats them, with the symmetrisation postulate, Slater determinants and the spin-statistics connection quoted, and the Heisenberg equation of motion for operators

Learning outcomes

  • Derive field equations, the energy-momentum tensor and conserved charges from a Lagrangian density with the field Euler-Lagrange equation and Noether's theorem.
  • Quantise the real and complex Klein-Gordon fields canonically, writing H, momentum and charge in normal-ordered modes and identifying particles and antiparticles of positive energy.
  • Evaluate the vacuum amplitude D(x - y) and the Pauli-Jordan commutator, show that only the commutator vanishes at spacelike separation, and explain why the negative-frequency, antiparticle term is needed for it to vanish.
  • Carry canonical commutators and anticommutators through the Dirac field's mode expansion, showing which rule yields negative norms or energy unbounded below and which yields positive energy, exclusion and positrons without a sea.
  • Show that anticommutators for a scalar field leave local observables non-commuting at spacelike separation, and say for each wrong quantisation whether positivity, causality or both exclude it.
  • List the assumptions of the spin-statistics connection, separate the free-field argument derived here from the general theorems quoted, and name the escape that anyons in two dimensions exploit.

Investigations

Microcausality on a lattice: the commutator and the anticommutator of a Klein-Gordon field

For a 1+1-dimensional Klein-Gordon field put on a lattice, which breaks Lorentz invariance, how far does the field commutator leak outside the continuum light cone, does the leak vanish as the lattice spacing shrinks, and does the anticommutator that fermionic quantisation would give converge instead to a nonzero spacelike value?

Exact mode sums for N sites with periodic boundaries, in units ℏ = c = 1 at fixed mass m, giving heat maps of the commutator and the anticommutator over x and t with the continuum light cone drawn; the commutator at three fixed spacelike points as the spacing is halved repeatedly, with the fitted rate at which the leak falls; the spacelike anticommutator compared with its closed form (1/π) K₀(m s), s the invariant interval; a check that both continuum limits depend on x and t only through s, the commutator inside the cone also on the sign of t; and a check that the box is long enough for wrap-around not to reach the points tested.

Missing lines of oxygen-16: Bose symmetry of spin-zero nuclei in the A band

Are the oxygen A-band absorption lines that Bose symmetry of spin-zero oxygen-16 nuclei forbids, those from even-N rotational levels of the ground state, absent from a laser absorption spectrum of air, and what upper limit does the measurement set on the fraction of molecules in the forbidden states?

A 763 nm diode laser tuned across allowed lines and the predicted position of a forbidden one, positions computed from quoted rotational constants and the frequency axis calibrated on neighbouring allowed lines or an etalon; the weak lines of the 16O18O isotopologue, whose nuclei are not identical and which has both N parities, identified so they are not mistaken for violations; the absorbance at the forbidden position compared with the noise floor and with the strength the line would have if even-N levels were populated, interpolated from neighbouring allowed lines with Boltzmann and line-strength factors; the resulting upper limit on the forbidden fraction; and the published laser-spectroscopy limits, from 1996 onwards, quoted for comparison.

Practice focus

Carrying each quantisation rule through a free field's mode expansion to its Hamiltonian, charge, norms and spacelike commutator or anticommutator, tracking every constant normal ordering drops, and saying for each conclusion which assumption it uses and whether it was derived here or quoted

Quantise a free complex field four ways: Klein-Gordon or Dirac, with commutators or with anticommutators. For each, write H and Q in modes, say which states have negative norm or negative energy and whether relabelling creators and annihilators can cure it, and evaluate the spacelike commutator or anticommutator from the mode sums. Then say which of the four survive, which assumption each failure violates, why positivity excludes commutators for the Dirac field although its canonical commutator is causal, while anticommutators for the scalar pass positivity and fail causality once norms are positive, what the antisymmetry of b-dagger(1) b-dagger(2)|0⟩ adds to Quantum Mechanics II's postulate, and what the general theorems quoted for interacting fields and anyons in two dimensions add or remove.

Unit 10 · Course sequence

Second Quantisation and the Hartree-Fock Method

Second quantisation packages indistinguishable particles into occupation numbers. Hartree–Fock varies a single Slater determinant, incorporating direct and exchange terms within a restricted trial space. Self-consistency means orbitals agree with their mean field. It does not establish exactness, particularly when several configurations compete.

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Nine lessons and complete unit specification
  1. From the Pauli field to occupation-number states on any basis
  2. Field operators, change of basis and the wavefunction recovered
  3. One-body operators: the sum of ⟨i|f|j⟩ c-daggerᵢ cⱼ
  4. Two-body operators and the many-electron Hamiltonian
  5. The energy of a single determinant: direct and exchange terms
  6. The Hartree-Fock equations derived
  7. Koopmans' and Brillouin's theorems: what orbital energies mean
  8. Closed-shell helium in restricted Hartree-Fock, solved numerically
  9. Two electrons on two sites: the Hubbard dimer, superexchange and one determinant's failure

Unit overview

Many-body quantum mechanics on Fock space, reached as the non-relativistic limit of Unit 9's fields and set up on any single-particle basis. Occupation-number states, field operators and changes of basis are built for bosons and fermions, and one- and two-body operators are derived from their first-quantised forms. A single determinant's energy splits into direct and exchange terms by Wick's contractions; making it stationary gives the Hartree-Fock equations, whose results Quantum Mechanics II quoted, with Koopmans' and Brillouin's theorems. Closed-shell helium is solved numerically to −77.87 eV, defining the correlation energy, and the two-site Hubbard model, solved exactly, gives superexchange and shows where one determinant fails. Configuration interaction and Moller-Plesset perturbation theory are named only; the electron and Bose gases are Unit 15's.

Prerequisites

  • Unit 9's quantised fields: mode expansions with [a, a-dagger] = δ for the scalar field and {b, b-dagger} = δ for the Dirac field, normal ordering, and antisymmetric many-particle states b-dagger(1) ... b-dagger(N)|0⟩
  • Identical particles as Quantum Mechanics II treats them: the symmetrisation postulate, spin-orbitals, Slater determinants with prefactor 1/√(N!), and a two-electron singlet paired with a symmetric spatial state
  • The direct and exchange integrals J and K of excited helium, and the central-field approximation and Hartree's self-consistent field as Quantum Mechanics II described them
  • The variational theorem and helium's ground state with an effective nuclear charge: the averaged repulsion (5/8) Z e²/(4 pi ε₀ a), the −77.5 eV bound and the measured −79.0 eV
  • Constrained extremisation with Lagrange multipliers, and variation of a functional with a complex function and its conjugate treated as independent
  • Numerical integration of a radial differential equation on a grid, the potential of a spherical charge density from Gauss's law, and diagonalisation of a small Hermitian matrix

Learning outcomes

  • Construct boson and fermion occupation-number states on a chosen orbital basis, act on them with creation and annihilation operators carrying the correct √(n + 1) factors and ordering signs, and verify the anticommutation relations on a three-orbital example.
  • Convert a first-quantised one-body or two-body operator into second-quantised form, justify the operator order of the two-body term, and transform both to another orbital basis.
  • Evaluate the energy of a single Slater determinant by contractions, identifying the direct and exchange terms and showing why no electron repels itself.
  • Derive the Hartree-Fock equations by constrained variation, state Koopmans' theorem with its frozen-orbital assumption and Brillouin's theorem with the stationarity it rests on, and explain why the total energy is not the sum of the orbital energies.
  • Solve closed-shell helium's restricted Hartree-Fock equation to self-consistency on a grid, reproduce −77.87 eV and the 1s orbital energy, and separate Koopmans' error in the ionisation energy into its frozen-orbital and correlation parts.
  • Diagonalise the two-site Hubbard model exactly, extract the exchange coupling 4t²/U, and compare restricted and unrestricted Hartree-Fock with the exact ground state to show where one determinant fails.

Investigations

Restricted Hartree-Fock along the helium isoelectronic sequence

Does a self-consistent radial Hartree-Fock code reach helium's −77.87 eV and −ε₁s = 24.98 eV, is the correlation energy, measured against quoted exact non-relativistic energies, nearly independent of Z from Li+ to Ne8+ while the total energy grows as Z², and does Hartree-Fock bind H-minus, which Quantum Mechanics II proved is bound?

Total and orbital energies converged in grid spacing, outer radius and iteration count until the fourth decimal in hartree stops changing; the virial ratio -⟨V⟩/⟨T⟩ = 2, which a converged Hartree-Fock solution satisfies, as an internal check; helium compared with the published Hartree-Fock limit, quoted; correlation energies for Z = 1 to 10 against quoted exact non-relativistic energies, plotted against Z; and the H-minus energy set against the −13.6 eV threshold, with a statement of why an energy above it proves nothing about binding.

Second-quantised operators as matrices: the Hubbard dimer and ring, exact and in Hartree-Fock

Built from creation and annihilation matrices with Jordan-Wigner signs, does exact diagonalisation reproduce the dimer's (U - √(U² + 16t²))/2, and as U/t runs from 0 to 20, how do restricted and unrestricted Hartree-Fock energies and the exact singlet-triplet gap compare with 4t²/U on the dimer and on a four-site ring at half filling, taken with antiperiodic boundary conditions so that its non-interacting ground state is a closed shell?

c and c-dagger for every spin-orbital built as matrices on the full Fock space with all anticommutators checked to machine precision; the Hamiltonian assembled from them, N and Sz conservation verified, and each sector diagonalised; the dimer spectrum against the analytic formulas; restricted and unrestricted self-consistent energies, with the U at which the unrestricted solution first breaks spin symmetry, 2t for the dimer; the exact gap divided by 4t²/U plotted against U/t; and the correlation energy, exact minus restricted, plotted on the same axis.

Practice focus

Manipulating creation and annihilation operators with consistent ordering signs, moving Hamiltonians between first and second quantisation, and deriving and testing the Hartree-Fock approximation, saying at each step what a single determinant includes and what it leaves to correlation

Write the Hamiltonian of two electrons on two sites, or of helium in a basis of 1s and 2s orbitals, in second quantisation; find the best single determinant both by contractions and by the Hartree-Fock equations; and set it against the exact ground state in that basis, from diagonalisation in the full two-electron space it spans. Then say what Koopmans' theorem predicts for the ionisation energy, why its frozen-orbital and correlation errors have opposite signs and why the first vanishes for the symmetric dimer, which excited determinants the exact ground state contains and why Brillouin's theorem keeps single excitations out of the first correction, and which features of the result belong to the basis rather than to the atom.

Unit 11 · Course sequence

The Quantised Radiation Field

Quantising the transverse radiation field turns each mode into an oscillator with discrete excitations. The vacuum has no photons but still has field fluctuations. An excited atom can exchange one excitation with an initially empty cavity mode; coupling to that single mode produces reversible oscillation, not irreversible emission into free space.

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Nine lessons and complete unit specification
  1. Maxwell's equations in Coulomb gauge
  2. The transverse field as a set of oscillators
  3. Quantising the field: A, E and B as operators
  4. Photons: energy, momentum, polarisation and helicity
  5. Vacuum fluctuations: ⟨E²⟩ and its spectrum
  6. The Casimir force between conducting plates
  7. Coherent states of a mode and the classical field
  8. The atom-field Hamiltonian ordered in powers of e
  9. One atom in one mode: the Jaynes-Cummings model

Unit overview

The electromagnetic field quantised in Coulomb gauge, the only gauge field the course treats, and carried as far as one atom in one mode. Maxwell's equations separate into an instantaneous Coulomb interaction and a transverse field whose modes are oscillators; quantising them as Unit 9 quantised the scalar field makes A, E and B operators, E and B with local commutators, and gives photons with energy, momentum, two helicities and no longitudinal state. The zero-point spectrum Quantum Mechanics II assumed for Welton's estimate is derived and the Casimir pressure computed from a regulated mode sum. Coherent states recover the classical wave, the Pauli Hamiltonian with the quantised A is ordered in powers of e, and the Jaynes-Cummings model is solved exactly. Covariant quantisation is named only; emission rates, decay and level shifts are left to Units 12 and 13.

Prerequisites

  • Unit 9's canonical quantisation of free fields: a Lagrangian density and its conjugate momentum, box-normalised mode expansions with [a(k), a-dagger(k')] = δ, normal ordering of the zero-point sum, and the Pauli-Jordan commutator vanishing outside the light cone
  • Quantum Mechanics I's oscillator ladder algebra: number states, a-dagger|n⟩ = √(n + 1)|n + 1⟩ and a|n⟩ = √(n)|n - 1⟩; and the identity exp(X + Y) = exp(X) exp(Y) exp(-[X, Y]/2) when [X, Y] is a number, which neither earlier course derives, quoted from operator algebra
  • Classical electromagnetism with potentials: Maxwell's equations, gauge freedom, the split of a vector field into divergence-free and curl-free parts, the energy density (ε₀/2)(E² + c² B²), the momentum density ε₀ E x B, and linear and circular polarisation of plane waves
  • Minimal coupling, H = (p - qA)²/2m + q φ, and gauge transformations from Quantum Mechanics II's Unit 3, with the Pauli Hamiltonian (σ . (p - qA))²/2m and its g = 2 spin term as Unit 6 derived it
  • Quantum Mechanics II's semiclassical atom in light: the electric-dipole Hamiltonian and its long-wavelength condition, the equality of A . p and r . E amplitudes on resonance, and two-level Rabi dynamics in the rotating-wave approximation
  • Welton's Lamb-shift estimate from Quantum Mechanics II, which assumed a zero-point energy ℏ ω/2 per field mode, and the Euler-Maclaurin formula relating a sum to an integral, quoted from analysis

Learning outcomes

  • Separate Maxwell's equations in Coulomb gauge into an instantaneous Coulomb interaction and a transverse field, and show that the field energy splits exactly into the two.
  • Quantise the transverse field mode by mode, write A, E and B as operators with their normalisation constants, and derive from the field's energy, momentum and spin angular momentum that a photon carries ℏ ω, ℏ k and helicity plus or minus ℏ, with no longitudinal state.
  • Compute vacuum expectation values of field quantities, including the zero-point spectrum of ⟨E²⟩ that Welton's estimate assumed, and derive the Casimir pressure from a regulated mode sum, saying what the cutoff stands for and why the result does not depend on it.
  • Construct the coherent state a classical current produces, compute its photon-number distribution and g(2)(0), and say which measured values of g(2)(0) no classical field could produce.
  • Expand the Pauli Hamiltonian with the quantised A in powers of e, state which photon-number changes each term allows, and justify the dipole and rotating-wave approximations for a given atom and field.
  • Solve the Jaynes-Cummings model in its invariant 2 x 2 blocks, predict the vacuum Rabi splitting and the collapse and revival times for a coherent field, and explain why emission into a single mode does not decay.

Investigations

Photon statistics of laser and pseudothermal light: a Hanbury Brown-Twiss measurement

Does the normalised coincidence rate g(2)(τ) of a helium-neon laser stay at 1 for every delay, while laser light scattered from a rotating ground-glass disc reaches 2 at zero delay and falls over a correlation time set by the disc's speed, and does either result require the quantised field of this unit?

Coincidence histograms from two single-photon detectors behind a polariser and a 50:50 beam splitter, normalised by the product of the singles rates and the bin width, for the laser and for the scattered light at three disc speeds; the fitted zero-delay value and correlation time with uncertainties, the correlation time set against the illuminated spot size on the disc divided by its surface speed, the loss of contrast when the collecting aperture spans several speckles or the polariser is removed, depolarisation by the ground glass lowering g(2)(0) towards 1.5, dead-time and afterpulsing checked on the flat laser trace, and a statement that a classical field of fluctuating intensity predicts g(2)(0) of at least 1, so only a value below 1, Unit 14's antibunching, would demand quantisation.

Collapse and revival in the Jaynes-Cummings model: are revivals a sign of discrete photons?

For a resonant two-level atom in a cavity mode prepared in a coherent state of mean photon number n-bar from 4 to 100, does the atomic inversion collapse after about √(2)/g and revive near 2 pi √(n-bar)/g, and does the revival vanish when the Poisson sum over discrete n is replaced by a classical Rabi drive averaged over a continuous spread of intensities with the same mean and variance?

The inversion computed as the Poisson-weighted sum of cos(2g √(n + 1) t), checked against direct integration of the Schrodinger equation in a truncated Fock space with the truncation shown not to matter; collapse and revival times fitted for each n-bar and plotted against it on log-log axes with their slopes; the same inversion for the classical drive with a continuous intensity distribution, showing whether it collapses and whether it ever revives; and the effect of a detuning of a few g on the revival amplitude.

Practice focus

Building field operators from mode expansions, evaluating vacuum, number and coherent-state expectation values with ladder algebra, keeping every divergent mode sum regulated, and saying of each result whether it needs the quantised field or already follows from a classical field or Quantum Mechanics II's semiclassical treatment

A two-level atom with transition dipole d sits at the field maximum of a single cavity mode of mode volume V tuned to its transition. From the quantised field, find the r.m.s. vacuum field of the mode, the coupling g and the vacuum Rabi splitting, and state the condition on g and the detuning under which the rotating-wave approximation holds and the condition on the atom's size under which the dipole approximation does. Prepare the mode in a coherent state of mean photon number 10 and predict its photon-number distribution, its g(2)(0), and the collapse and revival times of the atomic inversion. Then say which of these results a classical field of the same mean intensity would reproduce, which it could not, and what Unit 12 must add before the atom can decay irreversibly.

Unit 12 · Course sequence

Spontaneous Emission and Radiative Decay from the Quantised Field

Spontaneous emission connects an atomic transition to the available radiation modes. The vacuum emission term survives when there are no incident photons. A broad continuum can carry the excitation away, while a single ideal mode can return it. A decay rate therefore describes an atom together with its electromagnetic environment.

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Nine lessons and complete unit specification
  1. Emission and absorption matrix elements: √(n) and √(n + 1)
  2. The A coefficient from the golden rule over empty modes
  3. The Einstein relations and Planck's law as outputs
  4. Magnetic-dipole emission and the 21 cm rate computed
  5. The Weisskopf-Wigner ansatz: exact equations in the one-excitation sector
  6. Exponential decay and the radiative level shift derived
  7. The emitted line: a Lorentzian from the photon amplitudes
  8. Emission depends on the modes: the Purcell factor
  9. Scattering of light: the Kramers-Heisenberg formula, Rayleigh and Thomson

Unit overview

Radiative decay derived from Unit 11's quantised field, discharging what Quantum Mechanics II quoted: the field-theoretic A coefficient, Weisskopf-Wigner decay and the 21 cm rate. The A . p coupling carries photon factors √(n) and √(n + 1), and the 1 that survives in the vacuum makes an undriven atom emit. The golden rule summed over empty modes gives the A coefficient without Planck's law, which follows with the Einstein relations as an output, and its magnetic-dipole analogue the 21 cm rate. The Weisskopf-Wigner method, exact for a two-level atom in the rotating-wave approximation until a stated Markov step, yields exponential decay at Γ = A, a principal-value shift left divergent for Unit 13, and the Lorentzian line. The Purcell factor shows the rate belongs to atom and modes together, and the Kramers-Heisenberg formula takes light scattering from Rayleigh to Thomson.

Prerequisites

  • Unit 11's quantised radiation field: A as a sum over box modes with amplitude √(ℏ/(2 ε₀ ωₖ V)), E and B following from it, two polarisations perpendicular to each k, photon number states, and the mode density ω²/(π² c³) per unit volume and angular frequency
  • Unit 11's atom-field Hamiltonian ordered in powers of e, with A . p changing photon number by one, A² by zero or two, the spin term −μ . B and the dipole approximation, and its one-mode Jaynes-Cummings solution with vacuum Rabi frequency 2g
  • Fermi's golden rule with a density of final states, its window of validity, the quadratic start of every decay and second-order amplitudes through virtual intermediate states, as Quantum Mechanics II derived them
  • Quantum Mechanics II's semiclassical radiation theory, kept for comparison: the dipole matrix element with pfi = i m ωfi rfi, δ-m selection rules and line polarisations, the hydrogen 2p matrix element (2¹⁵/3¹⁰) a², Einstein's detailed-balance argument, oscillator strengths and the Thomas-Reiche-Kuhn sum rule
  • Hydrogen's hyperfine states F = 1 and F = 0 built from the electron and proton spins, split by 1420 MHz, and the static polarisability of the ground state
  • The Boltzmann distribution, and the delta function and principal value as limits of integrals over time

Learning outcomes

  • Derive the √(n) and √(n + 1) photon factors from the quantised A . p coupling, and explain why an undriven excited atom emits in the field vacuum while Quantum Mechanics II's semiclassical atom never decays.
  • Derive A = ω³ |d|²/(3 π ε₀ ℏ c³) by summing the golden rule over modes, polarisations and directions, and use it and its magnetic-dipole analogue to compute the hydrogen 2p and 21 cm rates and the angular pattern of each δ-m line.
  • Obtain the Einstein relations and Planck's spectrum as consequences of the n-bar and n-bar + 1 rates, and state which assumption each step of the argument needs.
  • Set up the Weisskopf-Wigner equations for a two-level atom coupled to a continuum of modes, carry out the Markov step to exponential decay at Γ = A with a principal-value shift and a Lorentzian line, and name each approximation and the departures it discards.
  • Compute the Purcell factor of a cavity from its Q and mode volume, and decide from g, kappa and Gamma whether an emitter in it decays exponentially or exchanges its energy reversibly with the mode.
  • Derive the Kramers-Heisenberg cross-section and reduce it to the Rayleigh, Thomson and resonant limits, identifying which terms of the coupling survive in each, including the sum-rule cancellation between A² and second-order A . p far below resonance.

Investigations

Beyond the Markov step: an emitter coupled to a discretised ω³ continuum

For a two-level emitter coupled to N discrete modes whose coupling-weighted density rises as ω³ up to a cutoff, over what window of times does the exact one-excitation solution follow exp(−Γ t) within 1 per cent, how does that window shrink as Γ/ω₀ is raised towards 0.1, and does the fitted frequency shift match the principal-value sum and grow with the cutoff as topic 12.06 predicts?

Topic 12.05's equations integrated, or the (N + 1) x (N + 1) matrix diagonalised, with the mode spacing fine enough that the recurrence time lies beyond the run, checked by halving it; ln |cₑ|² against t with residuals from exp(−Γ t), the initial curvature compared with 1 - (Δ H)² t²/ℏ², and any late-time departure plotted on log-log axes against the power the spectrum's lower edge predicts; the fitted shift against the principal-value integral for three cutoffs; and the final photon spectrum fitted to a Lorentzian whose width and centre are compared with Gamma and ω₀', its total probability checked against 1.

Predicting a fluorescence lifetime from an absorption band

Does the radiative rate that the Einstein relation of topic 12.03, in Strickler and Berg's form for a broad molecular band, predicts from rhodamine 6G's measured absorption spectrum in ethanol agree within combined uncertainty with the rate obtained from its lifetime measured by time-correlated single-photon counting and its fluorescence quantum yield?

Absorbance spectra at three or more concentrations inside the linear Beer-Lambert range, converted to molar extinction with path-length and concentration uncertainties propagated; the emission spectrum supplying the average of ν⁻³ over the fluorescence band and the solvent's refractive index entering as n²; decay curves from a pulsed diode laser with the instrument response recorded on a scatterer and deconvolved, fitted to one exponential with residuals shown; the quantum yield quoted or measured against a standard; and predicted and measured radiative rates compared, with the band formula's assumptions, mirror-image absorption and emission from one electronic transition with no change of geometry, stated and checked against the spectra.

Practice focus

Summing over photon modes with the right density, polarisation and solid-angle factors, tracking which approximation, dipole, rotating-wave, two-level or Markov, each step uses, and saying of each result whether it comes from the quantised field or was carried over from Quantum Mechanics II's semiclassical treatment

For the Balmer-α components 3d to 2p and 3p to 2s of hydrogen, compute from the quantised-field A coefficient the decay rates of 3d, 3p and 2p, with the radial integrals computed or quoted, and give each component's natural width, adding the widths of both levels where the lower one decays, set beside Quantum Mechanics II's 6 GHz Doppler width. Then find the temperature of a surrounding thermal field at which stimulated emission on the 3d to 2p line equals spontaneous emission, the Purcell factor of a cavity with mode volume λ³ and Q = 10⁴ at 656 nm, and whether the Markov treatment still holds in that cavity, saying for every number which step was derived from the quantised field and which was quoted.

Unit 13 · Course sequence

Self-Energy and the Lamb Shift

Radiative corrections must account for contributions already included in measured parameters. Bethe’s mass subtraction removes the free-electron contribution that would otherwise be counted again. The remaining logarithm captures a leading bound-state shift, while cutoff dependence exposes the limits of the nonrelativistic calculation.

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Nine lessons and complete unit specification
  1. Second-order energy of a bound electron in the quantised field
  2. The divergence of the bound self-energy
  3. The free electron's self-energy as an electromagnetic mass
  4. Mass renormalisation: Bethe's subtraction
  5. The sum rule that confines the shift to s states
  6. Bethe's logarithm: the mean excitation energy
  7. The 2s shift computed: about 1040 MHz
  8. Bethe against Welton, and the ground-state shift
  9. What only relativistic QED supplies: where quantum field theory begins

Unit overview

The Lamb shift computed as Bethe did in 1947, discharging Quantum Mechanics II's quotation and lifting the 2S(1/2)-2P(1/2) degeneracy that Unit 7's Dirac energies keep to all orders. A bound electron's second-order energy in Unit 11's field diverges linearly with the photon cutoff; the free electron's matching divergence is an electromagnetic mass, and subtracting it, the course's one renormalisation step, leaves a logarithm. A commutator sum rule makes the rest a contact term of order α⁵ mc²/n³ on s states, and with the cutoff at mc² and Bethe's mean excitation energy, quoted and computed, 2s rises about 1040 MHz against the measured 1057.8 MHz. Welton's estimate returns with its lower cutoff fixed by the spectrum, QED's value and vacuum polarisation are quoted and the anomalous moment's share computed, and the course's core closes where quantum field theory begins.

Prerequisites

  • The quantised transverse field of Unit 11: A(r) as a sum over modes with amplitude √(ℏ/(2 ε₀ omega V)), two polarisations per wavevector, the mode density ω²/(π² c³), and the vacuum's zero-point fluctuations
  • The atom-field Hamiltonian ordered in powers of e, with its A . p and A² terms in the dipole approximation, and Unit 12's sum of a dipole coupling over directions and polarisations
  • Unit 12's Weisskopf-Wigner result: a decay rate and a level shift written as a principal-value sum over modes, the shift left unevaluated
  • Second-order perturbation theory with sums over bound and continuum states, and the double-commutator method behind the Thomas-Reiche-Kuhn sum rule
  • Hydrogen's states and matrix elements: |ψₙ₀₀(0)|² = 1/(π n³ a³), ⟨f|p|i⟩ = i m ωfi ⟨f|r|i⟩, and oscillator strengths including the continuum
  • The levels to be corrected: Unit 7's exact Dirac energies, which keep 2S(1/2) and 2P(1/2) degenerate, Unit 6's Darwin contact term, and Quantum Mechanics II's account of Lamb and Retherford's measurement and Welton's estimate

Learning outcomes

  • Derive the second-order energy of a bound electron coupled to the vacuum field through A . p, carrying the sum over modes and polarisations to the prefactor 2 α/(3 π m² c²), and show by closure that it grows linearly with the photon cutoff.
  • Compute the free electron's self-energy, interpret it as an electromagnetic mass, and carry out the mass subtraction, explaining why the linear divergence and the A² term drop out of every observable interval while a logarithm remains.
  • Derive the sum rule sumₘ |pₘₙ|² (Eₘ - Eₙ) = (ℏ²/2)<Laplacian of V> and use it to show that the shift is a contact effect of order α⁵ mc²/n³ times a large logarithm, acting on s states only.
  • Evaluate Bethe's formula for 2s and 1s with a quoted mean excitation energy, obtaining about 1040 MHz and 8.2 GHz, and state how far a factor of two in the cutoff moves each result.
  • Compute the Bethe logarithm of 2s from hydrogen's bound and continuum dipole matrix elements, checking the weights against the sum rule and reporting how much of them lies in the continuum.
  • Separate what this unit derives from what it quotes: the self-energy, the mass subtraction and Welton's coefficient are derived, while the covariant removal of the cutoff, vacuum polarisation, Schwinger's a and the QED value are quoted, each with the theory that supplies it.

Investigations

Bethe's logarithm computed from hydrogen's spectrum

Does a sum over hydrogen's bound and continuum dipole matrix elements reproduce ln(K₀/Ry) = 2.81 for 2s and 2.98 for 1s, what fraction of each weight lies above the ionisation threshold, and how large must the basis be before the logarithm settles to 0.01?

p-wave pseudostates from diagonalising the radial Hamiltonian in an even-tempered Slater or Laguerre basis whose exponents span several decades, the Thomas-Reiche-Kuhn sum and the sum-rule denominator 2/n³ in atomic units reproduced to a stated precision, length and velocity forms of pₘₙ compared as a test of the basis, ln(K₀/Ry) for 1s and 2s tabulated against basis size with an extrapolation, the continuum share of the weights, and the resulting 1s and 2s shifts with the cutoff at mc² set beside 8.17 GHz and 1057.8 MHz together with the 9 per cent spread a factor of two in the cutoff produces.

Resolving the Lamb shift in Balmer-α by Doppler-free spectroscopy

Can saturated-absorption or polarisation spectroscopy of Balmer-α in a deuterium discharge separate the 2S(1/2)-3P(3/2) and 2P(1/2)-3D(3/2) components, which the Dirac theory places at one frequency, and does their separation agree with a 2s shift near 1.05 GHz and exclude zero?

A 656 nm external-cavity diode laser scanned across the line, its frequency axis calibrated by a confocal Fabry-Perot of known free spectral range and checked for scan linearity, the Doppler-free spectrum with crossover resonances identified from shared levels, fitted centres and widths of the two components as discharge pressure and pump power are varied, deuterium's 41 MHz 2S hyperfine splitting included in the line shape, and the fitted separation with its uncertainty compared with zero, with Bethe's 1040 MHz and with the quoted QED Lamb shift less the difference of the 3P(3/2) and 3D(3/2) shifts, a few MHz, also quoted.

Practice focus

Carrying a second-order self-energy from the mode sum to a number in MHz, separating at each step the divergence absorbed into the observed mass from the finite logarithm that moves s states, and saying which inputs are derived here, which are computed from hydrogen's spectrum and which are quoted from relativistic quantum electrodynamics

For hydrogen's 2s and 1s levels, write the second-order self-energy from the A . p coupling, show that it diverges linearly with the cutoff, subtract the free electron's electromagnetic mass, and reduce what remains with the commutator sum rule to (4 α⁵ mc²/(3 π n³)) ln(K/K₀). Evaluate both shifts with the quoted Bethe logarithms and the cutoff at mc², compare them with the measured 1057.8 MHz and 8.17 GHz, and say whether the agreement is better than a factor of two in the cutoff allows. Then explain why 2P(1/2) is unshifted at this order, why the formula fails for a hydrogen-like ion of large Z, and which contributions a covariant QED calculation adds.

Unit 14 · Optional extension

Open Quantum Systems and the Master Equation

A subsystem can lose purity even while the larger system evolves unitarily. Tracing out an environment keeps the statistics accessible to local measurements and discards inaccessible correlations. Quantum channels organize that reduced dynamics; their probabilities and matrix elements must still define a positive, unit-trace density operator.

Open this unit →
Nine lessons and complete unit specification
  1. Reduced dynamics and the Kraus representation
  2. Amplitude damping, phase damping and depolarisation of a qubit
  3. The Born-Markov master equation for an atom in the vacuum field
  4. The Lindblad form, the GKSL theorem and a thermal reservoir
  5. The damped cavity mode: coherent states survive, superpositions do not
  6. Optical Bloch equations for a driven, damped two-level atom
  7. Resonance fluorescence: the Mollow triplet and antibunched photons
  8. Quantum trajectories: unravelling the master equation into quantum jumps
  9. Pointer states, and what decoherence explains and leaves open

Unit overview

An extension unit, trimmed after Unit 15 when a term is short, that follows Unit 12's atom and Unit 11's cavity mode once their environments are traced out. A joint unitary and Quantum Mechanics II's partial trace give the Kraus representation, and three qubit channels define T₁ and T₂. The Born, Markov and secular approximations turn the atom-field coupling into a master equation of Lindblad form whose rate and shift are Unit 12's Weisskopf-Wigner values; the general GKSL theorem is quoted. The damped mode, the optical Bloch equations, resonance fluorescence with the Mollow triplet and antibunching, and quantum-jump trajectories follow, with the quantum regression theorem quoted. Decoherence, which Quantum Mechanics II named only, is computed, and the measurement problem it leaves is stated, not solved.

Prerequisites

  • Density operators: the trace rule, the spin-half Bloch ball, the von Neumann equation and the partial trace, with the singlet's maximally mixed halves and measurement modelled as entanglement with a pointer
  • Time-dependent perturbation theory in the interaction picture, the Dyson series to second order and Fermi's golden rule, with the rotating frame, the rotating-wave approximation and the exact Rabi solution of magnetic resonance
  • The quantised radiation field in Coulomb gauge: mode operators, the dipole coupling of an atom, coherent states and the one-mode Jaynes-Cummings dynamics
  • Radiative decay from the quantised field: emission factors n-bar + 1 and absorption factors n-bar, the Weisskopf-Wigner equations with their Markov step, Gamma equal to the A coefficient and the principal-value level shift
  • Oscillator ladder algebra: a|α⟩ = α|α⟩, displaced vacua and the overlap |⟨β|α⟩|² = exp(-|α - β|²)
  • Linear differential equations with constant coefficients solved by eigenvalues or Laplace transforms, Fourier transforms of correlation functions, and enough programming to integrate a matrix equation and sample random jump times

Learning outcomes

  • Derive the Kraus operators of a system from its joint unitary with an environment and an uncorrelated initial state, check that sum Kₖ-dagger Kₖ = 1, and show with half of a singlet why such maps must be completely positive, not merely positive.
  • Derive the master equation of a two-level atom in the vacuum field from second-order perturbation theory, naming where the Born, Markov and secular approximations enter, and identify its rate and shift with Unit 12's Weisskopf-Wigner values.
  • Solve the optical Bloch equations in steady state for any Rabi frequency and detuning, obtaining the saturated population and the power-broadened width, and trace T₁ and T₂, with T₂ at most 2T₁, to amplitude and phase damping.
  • Compute how fast the interference between |α⟩ and |-α⟩ decays in a lossy cavity and how a qubit's coherence decays under a σz coupling, and use both to say which states an environment selects as pointer states.
  • Compute the resonance-fluorescence spectrum and g(2)(τ) of a driven atom with the quantum regression theorem, and simulate quantum-jump trajectories whose average reproduces the master equation.
  • Separate what this unit derives from what it quotes, namely Stinespring's theorem, the GKSL theorem, the quantum regression theorem and the experiments, and state what decoherence explains and what it leaves open.

Investigations

T₁, T₂ and the spin echo in pulsed proton NMR

For protons in glycerine, mineral oil and water doped with copper sulphate, do inversion recovery and the Hahn echo show exponential relaxation with T₂ at most 2T₁, and how much of the free-induction decay time T₂* is reversible dephasing in the magnet's inhomogeneous field, which an echo undoes, rather than decoherence, which it cannot undo?

Inversion-recovery magnetisations fitted to M₀(1 - 2 exp(−t/T₁)), with the null near T₁ ln 2 as a check; Hahn-echo heights against 2 tau fitted to exp(−2 τ/T₂), repeated with a Carr-Purcell-Meiboom-Gill train to remove the extra decay that diffusion through the field gradient adds at long tau; T₂* from the free-induction decay set beside T₂; both relaxation rates for four or more copper sulphate concentrations plotted against concentration with their intercepts; and every pair of times checked against T₂ at most 2T₁ within its uncertainty.

Quantum jumps against the optical Bloch equations

Does the average of N quantum-jump trajectories of a resonantly driven atom converge to the optical Bloch solution with an error falling as 1/√(N), and do the simulated detection times alone reproduce g(2)(τ), including g(2)(0) = 0 and its change from monotonic rise to damped oscillation as Ω passes Γ/4?

Trajectories generated by non-Hermitian evolution with random jumps for Ω/Γ from 0.1 to 10; the averaged excited population set against direct integration of the master equation, with the root-mean-square error plotted against N on log-log axes and its slope fitted; the histogram of all pairs of detection-time separations, normalised by the squared mean rate, set beside g(2)(τ) from the quantum regression theorem; the waiting-time distribution of consecutive detections shown to agree with it only for tau short against the mean waiting time; and a check that halving the time step changes nothing beyond the statistical error.

Practice focus

Deriving open-system dynamics from a stated system-environment model with each approximation named where it enters, solving the resulting linear equations for populations, coherences and correlation functions, and saying of each result whether it was derived here or quoted, as the GKSL and quantum regression theorems are

A two-level atom with Unit 12's decay rate Gamma sits in a thermal field of mean occupation n-bar at its transition frequency. Derive its master equation from the atom-field coupling, naming where the Born, Markov and secular approximations enter, and find T₁, T₂ and the steady state. Then set n-bar to zero, drive the atom on resonance with Rabi frequency Ω, and find the steady-state Bloch vector, the positions and weights of the Mollow triplet for Omega much larger than Γ, and g(2)(0); simulate quantum-jump trajectories whose average reproduces your steady state. Finally say which results rest on the quoted GKSL or quantum regression theorems, and what the master equation would get wrong for the same atom in a cavity whose coupling g exceeds both the cavity loss and Gamma.

Unit 15 · Optional extension

Many-Body Applications: the Electron Gas and the Bose Gas

Many-body approximations use reference states: a filled Fermi sea exposes electron exchange, while a macroscopically occupied Bose mode supports collective excitations. These quasiparticles differ, and each approximation depends on density, interactions and the observables being predicted.

Open this unit →
Nine lessons and complete unit specification
  1. The jellium Hamiltonian in second quantisation
  2. The Fermi sea: kF and a kinetic energy of 2.21/rₛ² Ry
  3. The exchange energy of the electron gas: −0.916/rₛ Ry
  4. Hartree-Fock binding of a metal, and what correlation adds
  5. The Hartree-Fock spectrum and its logarithmic singularity at kF
  6. Holes in the Fermi sea: a non-relativistic Dirac sea
  7. The weakly interacting Bose gas and Bogoliubov's replacement
  8. The Bogoliubov transformation, phonons and depletion
  9. Landau's criterion and frictionless flow of a Bose gas

Unit overview

Unit 10's second quantisation applied to the two uniform systems where it reaches closed forms, the extension a shorter term trims first. For jellium, electrons on a neutralising background, the q = 0 Coulomb term cancels the background and the Fermi sea's kinetic and exchange energies, 2.21/rₛ² and −0.916/rₛ Ry per electron, are derived; their sum binds the gas near rₛ = 4.8, while the Hartree-Fock spectrum's logarithmic singularity at kF contradicts measured specific heats, correlation energies being quoted and screening named. Holes in the Fermi sea are Unit 8's Dirac sea without its gap. For a dilute Bose gas coupled through Quantum Mechanics II's scattering length, Bogoliubov's transformation gives phonons and the depletion of the condensate, and Landau's criterion frictionless flow below the sound speed. Green's functions and the random-phase approximation are not used.

Prerequisites

  • Second quantisation from Unit 10: c and c-dagger with their anticommutators, a and a-dagger with the factor √(n + 1), one- and two-body operators written as sums over matrix elements, and the direct and exchange energy of a single determinant
  • The Hartree-Fock equations, Koopmans' theorem and the definition of the correlation energy, all from Unit 10
  • Unit 8's hole theory and Unit 9's d operators: a filled sea whose vacancies carry reversed charge, momentum and spin, and excitation energies made positive by anticommutation, normal ordering only removing the constant
  • Low-energy scattering from Quantum Mechanics II: the scattering length aₛ, the first Born approximation and the reduced mass m/2 of two identical particles
  • Box normalisation with periodic boundary conditions, the replacement of a momentum sum by V/(2 π)³ times an integral over d³k, and the Fourier transform of the Coulomb potential, e²/(ε₀ q²)
  • Fermi-Dirac and Bose-Einstein occupation numbers, the density of states of particles in a box and the linear electronic specific heat of a metal, from statistical physics

Learning outcomes

  • Write the jellium Hamiltonian on plane waves, show how the q = 0 term cancels the background, and use scaling in rₛ to explain why high density is the weakly interacting limit.
  • Derive the kinetic and exchange energies per electron of the Fermi sea in rydbergs, find the Hartree-Fock equilibrium rₛ and the rₛ beyond which Hartree-Fock makes the gas ferromagnetic, and state what correlation changes in each.
  • Compute the Hartree-Fock single-particle energy of the electron gas, locate its logarithmic singularity at kF, and explain why it contradicts the measured specific heat and bandwidth of a simple metal and how a screened interaction removes it.
  • Recast the Fermi sea as a vacuum of particle and hole operators and compare its excitations, term by term, with Unit 8's Dirac sea and Unit 9's positrons.
  • Apply Bogoliubov's replacement and transformation to a dilute Bose gas to derive the phonon spectrum, the sound speed, the healing length and the condensate depletion, checking each against n aₛ³ much less than 1.
  • Use Landau's criterion to decide whether an obstacle moving through a Bose gas can dissipate energy, and explain why the ideal gas cannot flow without friction while the interacting gas can.

Investigations

The Hartree-Fock electron gas computed: exchange energy, the kF singularity and screening

Computed from discretised momentum sums, does the exchange energy of jellium converge to −0.916/rₛ Ry, does the Hartree-Fock slope of εₖ at kF grow without limit as the grid is refined, and below what screening wavenumber kₛ, as a fraction of kF, does the effective mass at kF at sodium's rₛ of about 4 depart from the free mass by more than 10 per cent?

The exchange energy from grid or Monte Carlo sums over pairs in the Fermi sphere at several resolutions, extrapolated and compared with −0.916/rₛ Ry; εₖ on a fine grid checked against the closed form in F(k/kF); the finite-difference slope at kF against grid spacing on a logarithmic axis, growing linearly in ln(1/δ k); the same calculation with a Yukawa-screened vq for kₛ/kF from 0.01 to 3, the Thomas-Fermi value of about 1.6 included, giving m*/m and the implied specific-heat coefficient, with the kₛ at which the 10 per cent threshold is crossed; and a statement that a fixed kₛ is a model, the random-phase approximation that would justify it, with dynamic screening, being named only.

Bogoliubov theory against exact diagonalisation for bosons on a ring

For N bosons on a ring of L sites with hopping t and on-site repulsion U, does the single-quasiparticle state that exact diagonalisation finds in each total-momentum sector follow the Bogoliubov dispersion Eₖ = √(eₖ(eₖ + 2Un)) with eₖ = 2t(1 - cos k), is the depletion of k = 0 the predicted one, and at what Un/t does the lowest excitation at k = 2 π/L miss the Bogoliubov value by 10 per cent?

The Hamiltonian built on occupation-number states of the momentum modes and blocked by total momentum, for N = L up to 10 (92 378 states at N = L = 10, about a tenth of that per sector); in each sector the eigenstate carrying the largest weight of the density fluctuation ρ-daggerₖ = sum over p of a-dagger(p+k) aₚ acting on the ground state, its energy above the ground state plotted against k beside the Bogoliubov curve, with the lowest state of each sector beyond k = 2 π/L, in which several quasiparticles of smaller momentum share k at lower energy, shown separately and not mistaken for the Bogoliubov branch; the condensate fraction ⟨n₀⟩/N from the ground state against the lattice sum of vₖ²; the fractional error of the k = 2 π/L excitation against Un/t on a logarithmic axis with its 10 per cent crossing; a check that at small U that excitation tends to eₖ + U(N - 1)/L, first-order perturbation theory, which is Bogoliubov's eₖ + Un up to a 1/N correction; and a note that a finite ring has a condensate although an infinite one-dimensional gas has none.

Practice focus

Carrying second-quantised operators through to closed-form energies of uniform systems: normal ordering against a Fermi sea or a condensate, reducing momentum sums to integrals, checking each result against its dimensionless parameter, rₛ or n aₛ³, and saying where one determinant or Bogoliubov's quadratic theory stops and which corrections are quoted

For sodium, with rₛ about 3.9, compute the jellium kinetic and exchange energies per electron, the Hartree-Fock occupied bandwidth against the free-electron one, and the rₛ at which Hartree-Fock would make the gas ferromagnetic, then say what correlation and screening change and which of your numbers a measurement contradicts. Then, for a sodium condensate with n = 10²⁰ m⁻³ and aₛ about 2.75 nm, compute g, n aₛ³, the sound speed, the healing length and the depletion, state Landau's critical velocity, and explain why liquid helium-4, with a condensate fraction under 10 per cent, lies outside the theory you used.

Keep this beside your working

A convention and notation guide

Conventions and cautions for studying Advanced Quantum Mechanics
Units and four-vectorsUnless a lesson explicitly says otherwise, keep ħ and c. Use xμ = (ct, x), metric (+, −, −, −) and pμ = (E/c, p). Check factors before comparing a natural-unit reference.
States and time reversalA ket denotes a state vector; its overall phase does not change its ray. K means coefficient conjugation in a stated basis. Antiunitary Θ conjugates scalars: Θ(aψ) = a*Θψ.
Dirac adjointψ̄ = ψ†γ⁰ is not ψ†. State the γ-matrix representation; this course normally uses the Dirac representation. A boost is not a unitary matrix in this finite-dimensional spinor space.
Operator brackets[A, B] = AB − BA; {A, B} = AB + BA. A parenthesised comma expression used as an anticommutator in a lesson means the same AB + BA. Keep operator ordering visible.
Rates and spectral widthsA population decay rate Γ has units s⁻¹. An angular-frequency linewidth is measured in rad s⁻¹; converting to frequency in Hz introduces 2π. For an energy shift, use ΔE; for its frequency equivalent, use ΔE/h.
Model and approximationName the free-field, weak-coupling, Markov, point-nucleus or mean-field assumptions as appropriate. A cutoff estimate is not a full QED prediction or a rigorous uncertainty interval.
Mathematics used throughout
  • Antilinear and antiunitary operators, with complex conjugation K, used to build time reversal and charge conjugation
  • Four-vector index notation with the Minkowski metric, Lorentz generators as 4 x 4 matrices, and their exponentiation to finite rotations and boosts
  • The Clifford algebra of the gamma matrices in the Dirac and Weyl representations, with trace identities, spin sums and energy projectors
  • Separation in parabolic and spherical coordinates, and series solutions with non-integer exponents for the Coulomb scattering amplitude and the Klein-Gordon and coupled Dirac radial equations
  • Unitary transformations expanded in nested commutators, as in the Foldy-Wouthuysen reduction, and canonical Bogoliubov transformations of mode operators
  • Lagrangian densities, Euler-Lagrange field equations and Noether currents, and mode expansions of fields quantised with commutators or anticommutators
  • Fock-space algebra for bosons and fermions: creation and annihilation operators on any single-particle basis, normal ordering and Wick's contractions
  • Mode sums converted to integrals over densities of states, with cutoffs, regulators and principal values, and the Markov step that turns a memory integral into a rate
  • Kraus maps and Lindblad generators acting on density matrices, and numerical methods for self-consistent fields, sums over bound and continuum states, and quantum-jump trajectories

Read alongside the lessons

Primary course notes and further reading

These independent university resources support the concepts and offer further derivations. They have their own scope, notation and assessment; this course is not affiliated with their institutions.

MIT 8.321 · Quantum Theory I ↗

Lectures 22–23: antiunitary time reversal and Kramers degeneracy.

MIT 8.322 · Quantum Theory II ↗

Graduate notes on symmetry, scattering, relativistic quantum mechanics and radiation. Their sequence differs from this course.

David Tong · Quantum Field Theory ↗

The introductory and free-field sections support the relativistic and field bridge. The interacting-field chapters go beyond this course; compare natural-unit and spinor conventions.

John Preskill · Quantum Information, Chapter 3 ↗

Quantum channels, amplitude damping and Markov master equations; useful alongside optional Unit 14.

Complete course outcomes and scope

A fifteen-unit, fifteen-week third course in quantum mechanics that begins at the results Quantum Mechanics II quoted. Units 1 and 2 stay non-relativistic: time reversal is built as an antiunitary operator, giving Kramers degeneracy and reciprocity, and scattering is extended to spin and identical particles, through polarisation, singlet and triplet weights and Mott's formulas. Units 3 to 8 build relativistic one-particle theory: the Klein-Gordon equation and its failures, Dirac's equation and the proof of its covariance, the reduction that yields g = 2, spin-orbit coupling with the Thomas factor and the Darwin term, hydrogen's exact Dirac levels, and hole theory with charge conjugation. Unit 9 quantises free scalar and Dirac fields and derives the spin-statistics connection for them, and Unit 10 builds second quantisation and derives the Hartree-Fock equations. Units 11 to 13 quantise the radiation field in Coulomb gauge and derive spontaneous emission, Weisskopf-Wigner decay and Bethe's Lamb shift, closing the core at the threshold of quantum field theory. Units 14 and 15 extend to open systems and the master equation, then to the electron gas and the Bose gas.

  • Construct time reversal as an antiunitary operator, derive Kramers degeneracy and reciprocity from it, and show that a permanent electric dipole moment violates both P and T.
  • Compute amplitudes, polarisations and cross-sections for scattering with spin and with identical particles, from singlet and triplet weights in neutron-proton scattering to Mott's formulas for identical charged particles.
  • Explain why the Klein-Gordon equation fails as a one-particle wave equation, construct the Dirac equation from Dirac's requirements, and prove its Lorentz covariance.
  • Reduce the Dirac equation to the Pauli equation and, by the Foldy-Wouthuysen transformation, to order (v/c)², deriving g = 2, spin-orbit coupling with the Thomas factor built in and the Darwin term.
  • Solve the Dirac equation in a Coulomb field exactly, derive energies that depend on n and j alone, and say what the point-nucleus Dirac atom omits.
  • Reinterpret negative-energy solutions through hole theory and charge conjugation, quantise free scalar and Dirac fields, and show for spin 0 and spin 1/2 which choice of commutators or anticommutators keeps the energy bounded below and microcausality intact, stating what the argument assumes.
  • Write many-body Hamiltonians in second quantisation, derive the Hartree-Fock equations and apply them to helium and the electron gas, and treat the dilute Bose gas by Bogoliubov's transformation.
  • Quantise the radiation field in Coulomb gauge and derive from it the A coefficient, Weisskopf-Wigner decay with its level shift, Bethe's Lamb shift of about 1040 MHz and the master equation of a radiating atom.
  • Say of each result whether it was derived here or quoted from quantum electrodynamics or field theory, as the full Lamb shift, Schwinger's alpha over 2 pi and the general spin-statistics theorem are.

Irreducible core

Units 2, 4, 6, 7, 9, 10, 11, 12 and 13 are the irreducible core: they take up Quantum Mechanics II's stated next step, scattering with spin and identical particles, and derive what it quoted from relativistic, field and many-body theory: g = 2, the Thomas factor, the Darwin term, the exact Dirac levels, the spin-statistics connection, Hartree-Fock, the A coefficient, Weisskopf-Wigner decay and Bethe's Lamb shift.

Adaptable supporting material

Units 1, 3, 5 and 8 feed the core, so they shorten rather than drop, and Units 3 to 8 keep their order. Unit 1 can shrink to time reversal with spin, Kramers degeneracy and reciprocity, which Units 2 and 8 use; Unit 3 to covariant notation, the indefinite density and the non-relativistic limit, the magnetic and Coulomb solutions going; Unit 5 to the Lorentz generators, the covariance condition, ψ-bar, the bilinears and parity, which Units 6 to 9 use; and Unit 8, the midterm week, to holes, charge conjugation and the case for quantised fields.

Optional numbered extension

Units 14 and 15, open quantum systems with the master equation, then the electron gas and the Bose gas, are the extension a shorter term trims, Unit 15 first. Unit 14 needs Units 11 and 12 and Unit 15 needs Unit 10; everything this course derives from Quantum Mechanics II's quotations lands before them.

Beyond this course

Next comes quantum field theory proper: interacting fields, Feynman-diagram perturbation theory and renormalisation, which compute the full Lamb shift and the anomalous moment quoted here and prove the general spin-statistics and CPT theorems, and the non-abelian gauge theories University Physics V surveys. Beside it lie many-body Green's functions, screening and the random-phase approximation, correlated quantum chemistry, and quantum optics beyond one atom in one mode.

This GioPhysics course map is an adaptable learning sequence, not academic credit, accreditation, or a universal university syllabus. The sequel to Quantum Mechanics II, it re-teaches none of its methods and derives what it quoted from relativistic, field and many-body theory: g = 2, the Thomas factor, the Darwin term, the Dirac energies, spin-statistics, Hartree-Fock, spontaneous emission and Bethe's Lamb shift. Where it meets University Physics V, as at charge conjugation and decoherence, it derives what that survey states, with no nuclear or particle phenomenology. It quantises free fields and the Coulomb-gauge radiation field and stops where quantum field theory begins: one mass subtraction, no renormalisation programme, Feynman diagrams named only. A midterm is assumed in week 8. Follow your institution's published scope, notation, laboratory programme, and assessment rules.

GioPhysics University & College Physics is an independent learning pathway. GioPhysics is not a university, does not award academic credit or degrees, and is not accredited by or affiliated with any university or professional body. This is not a universal programme specification. Course coverage and degree requirements vary by institution; confirm requirements with your university.

Extra challenging questions

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