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American Journal of Physics

Gauge invariance in quantum mechanics: zero electromagnetic field

Donald H. Kobe, Kuo‐Ho Yang

Published Feb 1, 1983• 13 citations
Publisher

Abstract

The case of a single charged particle with potential energy is considered when the classical electromagnetic field is zero. The vector and scalar potentials describing this situation are not necessarily zero. When the conventional approach to radiation problems using the interaction A⋅p plus p⋅A plus A2 plus A0 (constants omitted) is used, time-dependent probabilities are predicted if the vector potential A=−∇Λ≠0 even though the electromagnetic field is zero. The reason for this unphysical behavior is that eigenfunctions of the unperturbed Hamiltonian, which is not gauge invariant, are used to calculate the probability amplitudes. When a manifestly gauge-invariant procedure is applied to this case the probabilities are constant in all gauges. The reason that physical results are obtained is that eigenstates of the energy operator are used to calculate the probability amplitudes.

DOI
10.1119/1.13316

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The case of a single charged particle with potential energy is considered when the classical electromagnetic field is zero. The vector and scalar potentials describing this situation are not necessarily zero. When the conventional approach to radiation problems using the interaction A⋅p plus p⋅A plus A2 plus A0 (constants omitted) is used, time-dependent probabilities are predicted if the vector potential A=−∇Λ≠0 even though the electromagnetic field is zero. The reason for this unphysical behavior is that eigenfunctions of the unperturbed Hamiltonian, which is not gauge invariant, are used to calculate the probability amplitudes. When a manifestly gauge-invariant procedure is applied to this case the probabilities are constant in all gauges. The reason that physical results are obtained is that eigenstates of the energy operator are used to calculate the probability amplitudes.
The conventional perturbation theory in quantum mechanics for the interaction of electromagnetic radiation with matter, which is based on the time-dependent vector and scalar potentials, is shown to be dependent on the gauge. The problem is reformulated, using the approach of Yang, in a gauge-invariant way, in which the transitions between states are induced by the quantum-mechanical power operator. In order to use an unperturbed Hamiltonian which does not involve the electromagnetic field, the gauge is chosen to give the electric dipole interaction. This choice can be made if the magnetic field is negligible and the electric field is slowly varying over atomic dimensions. For a comparison of the gauge-invariant and conventional formulation, a two-level atom in a radiation field is considered. For the probability that an atom originally in the lower state will make a transition to the upper state when the field is not in resonance, the gauge-invariant formulation gives the correct result, whereas the gauge-dependent formulation gives an incorrect result.
The amplitude for finding a particle in an unperturbed state is equal to the gauge-invariant probability amplitude for finding the particle in an energy eigenstate when the vector potential is turned off. The artificial practice in quantum mechanics of turning the vector potential on and off leads under some circumstances to unrealistic electromagnetic fields. For sudden switching of the potentials, a realistic electromagnetic field is obtained only when the vector potential and electromagnetic field are zero at the time of switching on and off. For the adiabatic case, a realistic electromagnetic field is obtained only in the limit when the potentials are turned on in the infinite past and turned off in the infinite future.
When the electromagnetic field is adiabatically switched on and subsequently switched off, the vector and scalar potentials can still be nonzero when the electromagnetic fiele is zero. In this case it is necessary to use the energy operator, not the Hamiltonian, to calculate the probability that the system is in an energy eigenstate. In the gauge in which the potentials are zero when the field is zero, the energy operator reduces to the unperturbed Hamiltonian and the usual procedure for calculating probabilities can be used.
The gauge-invariant formulation of quantum mechanics is applied to the charged harmonic oscillator in an electromagnetic field in the electric dipole approximation to obtain the probability that the oscillator is in a particular state at time t. This probability is compared with the corresponding 'probability' calculated from the conventional approach to the interaction of radiation with matter using the interaction A.p. The probabilities do not agree with each other. From the principle of gauge invariance it is concluded that the probability calculated from the gauge-invariant formulation is correct in this case, and that the conventional approach in general is incorrect.
A manifestly gauge-invariant formulation of quantum mechanics is applied to a charged isotropic harmonic oscillator in a time-varying magnetic field in the magnetic dipole approximation. The energy operator for the problem is the sum of the kinetic and potential energies. The kinetic energy operator is the square of the gauge-invariant kinetic momentum operator divided by twice the mass. The energy eigenvalues and state probabilities are calculated and are shown to be the same in all gauges. In this problem there is no gauge in which the energy operator reduces to the unperturbed Hamiltonian, as there is in the electric dipole approximation. Consequently, eigenvalues of the unperturbed Hamiltonian and corresponding (gauge-dependent) state 'probabilities' are different from the gauge-invariant quantities in all gauges.