Are current discontinuities in molecular devices experimentally observable?

Abstract

An ongoing debate in the first-principles description of conduction in molecular devices concerns the correct definition of current in the presence of non-local potentials. If the physical current density $\mathbf{j}=(-ie\hslash /2m)({\Psi }^{\ast }\nabla \Psi -\Psi \nabla {\Psi }^{\ast })$ is not locally conserved but can be re-adjusted by a non-local term, which current should be regarded as real? We prove that the extended Maxwell equations by Aharonov-Bohm give the e.m.\ field generated by such currents without any ambiguity. For an oscillating dipole we show that the radiated electrical field has a longitudinal component proportional to $\omega \hat{P}$, where $\hat{P}$ is the anomalous moment $\int \hat{I}(\mathbf{x})\mathbf{x}{d}^{3}x$ and $\hat{I}$ is the space-dependent part of the anomaly $I={\partial }_t\rho +\nabla \cdot \mathbf{j}$. In the case of a stationary current in a molecular device, a failure of local current conservation causes a "missing field" effect that can be experimentally observable, especially if its entity depends on the total current.

arXiv comment22 pages, 5 figures

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