Non-conservative current-driven dynamics: beyond the nanoscale

TL;DR

This paper explores how non-conservative current-driven forces induce dynamic atomic motion in long metallic nanowires, revealing a waterwheel effect that leads to non-equilibrium phonon modes and steady states beyond nanoscale dimensions.

Contribution

It introduces the concept of the waterwheel effect in metallic nanowires, linking non-conservative forces to non-local dynamical responses beyond nanoscale systems.

Findings

Waterwheel modes grow exponentially under current.

Steady states are achieved through self-regulation reducing current.

Current-induced response matrix is long-ranged at low bias.

Abstract

Long metallic nanowires combine crucial factors for non-conservative current-driven atomic mo- tion. These systems have degenerate vibrational frequencies, clustered about a Kohn anomaly in the dispersion relation, that can couple under current to form non-equilibrium modes of motion growing exponentially in time. Such motion is made possible by non-conservative current-induced forces on atoms, and we refer to it generically as the waterwheel effect. Here the connection be- tween the waterwheel effect and the stimulated directional emission of phonons propagating along the electron flow is discussed in an intuitive manner. Non-adiabatic molecular dynamics show that waterwheel modes self-regulate by reducing the current and by populating modes nearby in fre- quency, leading to a dynamical steady state in which non-conservative forces are counter-balanced by the electronic friction. The waterwheel effect can be described by an appropriate effective non- equilibrium dynamical response matrix. We show that the current-induced parts of this matrix in metallic systems are long-ranged, especially at low bias. This non-locality is essential for the characterisation of non-conservative atomic dynamics under current beyond the nanoscale.