Degenerate Perturbation Theory and the Variational Method · seed 1 · A4, ink-friendly. The answer key prints on its own page for grown-ups.
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When levels split and how to bound them

Science · Quantum & Modern Physics · ages 23-24
Name ______________________   Date ____________
  1. Which matrix gives the first-order shifts of an isolated degenerate energy?

    • V restricted to the degenerate eigenspace
    • H0 restricted to an unrelated non-degenerate eigenspace
    • V with its off-diagonal entries discarded before calculation
  2. Why can averaging V in arbitrary degenerate basis states miss the first-order energy shifts?

    • Every first-order energy expectation divides by the gap between those basis states.
    • A shared unperturbed energy forces every perturbation matrix element to vanish.
    • Off-diagonal perturbation elements can mix those basis states.
  3. For an admissible nonzero trial vector, the Rayleigh quotient gives a lower bound on the ground-state energy.

    Circle one:   True   False

  4. For H=H0+lambda V, E_d=8 eV and lambda=0.2. The restricted V eigenvalues are -3 eV and 1 eV. What are the first-order energies?

    • 5.0 eV and 9.0 eV
    • 7.8 eV and 8.2 eV
    • 7.4 eV and 8.2 eV
  5. The restricted perturbation matrix W has rows (1, 3) and (3, 1). What are its eigenvalues w?

    • -3 and 3
    • -2 and 4
    • 1 and 3
  6. Two admissible trial states for the same Hamiltonian give 4.8 eV and 5.2 eV. Which conclusion follows?

    • E0<=4.8 eV is the tighter upper bound.
    • E0>=5.2 eV is the tighter lower bound.
    • E0=4.8 eV because minimizing two trials proves exactness.
  7. For H=diag(4,9) eV and phi=(1/2,0), Mira reports <phi|H|phi>=1 eV as a trial energy below E0=4 eV. How should Mira correct the calculation?

    • Multiply 1 eV by the norm squared 1/4 to obtain 0.25 eV.
    • Treat the small coefficient as changing H's ground energy to 1 eV.
    • Divide 1 eV by the norm squared 1/4 to obtain 4 eV.
  8. In an orthonormal basis, H=diag(2,6) eV and phi=(1,1). What is the variational energy of this unnormalized vector?

    • 2 eV
    • 4 eV
    • 8 eV
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Answer key

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When levels split and how to bound them W1-mt_uov0PZ8vqy-s1

  1. V restricted to the degenerate eigenspace · Form W_ab=<a|V|b> within the degenerate eigenspace. Its eigenvalues supply the first-order corrections.
  2. Off-diagonal perturbation elements can mix those basis states. · The degenerate basis may not diagonalise V. Mixing within the shared-energy eigenspace must be treated before reading off shifts.
  3. False · The quotient is at least E0, so it bounds E0 from above.
  4. 7.4 eV and 8.2 eV · Multiply each w by lambda before adding E_d: 8-0.6=7.4 eV and 8+0.2=8.2 eV.
  5. -2 and 4 · det(W-wI)=(1-w)²-9=0, so 1-w=±3. The eigenvalues are -2 and 4.
  6. E0<=4.8 eV is the tighter upper bound. · Both trial energies bound E0 from above. The smaller ceiling, 4.8 eV, is tighter but need not be exact.
  7. Divide 1 eV by the norm squared 1/4 to obtain 4 eV. · Mira used an unnormalized numerator. Dividing by <phi|phi>=1/4 gives 4 eV, equal to the known ground energy.
  8. 4 eV · The numerator is 2+6=8 eV and the norm squared is 1+1=2. The Rayleigh quotient is 4 eV.
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