Gauge-Invariant Semi-Discrete Wigner Theory

TL;DR

This paper develops a gauge-invariant semi-discrete Wigner quantum theory applicable to small, bounded quantum systems, introducing a discretized momentum space and a simplified evolution equation for electromagnetic interactions.

Contribution

It presents a novel semi-discrete gauge-invariant Wigner equation with finite momentum quantization suitable for nanoelectronic systems, extending the continuous theory to bounded quantum regimes.

Findings

Derivation of a semi-discrete gauge-invariant Wigner equation

Simplification of the evolution equation in the long coherence length limit

Development of a computational model using finite differences and Fredholm integral equations

Abstract

A gauge-invariant Wigner quantum mechanical theory is obtained by applying the Weyl-Stratonovich transform to the von Neumann equation for the density matrix. The transform reduces to the Weyl transform in the electrostatic limit, when the vector potential and thus the magnetic field are zero. Both cases involve a center-of-mass transform followed by a Fourier integral on the relative coordinate introducing the momentum variable. The latter is continuous if the limits of the integral are infinite or, equivalently, the coherence length is infinite. However, the quantum theory involves Fourier transforms of the electromagnetic field components, which imposes conditions on their behavior at infinity. Conversely, quantum systems are bounded and often very small, as is, for instance, the case in modern nanoelectronics. This implies a finite coherence length, which avoids the need to regularize non-converging Fourier integrals. Accordingly, the momentum space becomes discrete, giving rise to momentum quantization and to a semi-discrete gauge-invariant Wigner equation. To gain insights into the peculiarities of this theory one needs to analyze the equation for specific electromagnetic conditions. We derive the evolution equation for the linear electromagnetic case and show that it significantly simplifies for a limit dictated by the long coherence length behavior, which involves momentum derivatives. In the discrete momentum picture these derivatives are presented by finite difference quantities which, together with further approximations, allow to develop a computationally feasible model that offers physical insights into the involved quantum processes. In particular, a Fredholm integral equation of the second kind is obtained, where the "power" of the kernel components, measuring their rate of modification of the quantum evolution, can be evaluated.