Abstract

The semiclassical equations of motion are widely used to describe carrier transport in conducting materials. Nevertheless, the substantial challenge of incorporating disorder systematically into the semiclassical model persists, leading to quantitative inaccuracies and occasionally erroneous predictions for the expectation values of physical observables. In the present work we provide a general prescription for reformulating the semiclassical equations of motion for carriers in disordered conductors by taking the quantum mechanical density matrix as the starting point. We focus on external electric fields, without magnetic fields, and spin-independent disorder. The density matrix approach allows averaging over impurity configurations, and the trace of the velocity operator with the disorder-averaged density matrix can be reinterpreted as the semiclassical velocity weighted by the Boltzmann distribution function. Through this rationale the well-known intrinsic group and anomalous velocities are trivially recovered, while we demonstrate the existence of an extrinsic interband velocity, namely a disorder correction to the semiclassical velocity of Bloch electrons, mediated by the interband matrix elements of the Berry connection. A similar correction is present in the non-equilibrium expectation value of the spin operator, contributing to spin-orbit torques. To obtain agreement with diagrammatic approaches the scattering term in the Boltzmann equation is corrected to first order in the electric field, and the Boltzmann equation is solved up to sub-leading order in the disorder potential. Our prescription ensures all vertex corrections present in diagrammatic treatments are taken into account, and to illustrate this we discuss model cases in topological insulators, including the anomalous Hall effect as well as spin-orbit torques.

Highlights

  • Carrier transport in extended conductors is an inherently semiclassical phenomenon, requiring an effective singleparticle description as well as averaging over real space and momentum space degrees of freedom

  • We have demonstrated that the semiclassical dynamics of electrons in disordered solids can be determined using linear response theory by taking the density matrix and quantum Liouville equation as the starting point

  • This results in a disorder-dependent correction to the semiclassical equation of motion for the carrier position, which we have termed the extrinsic velocity βmk and which accounts for the effect of disorder on the carrier velocity after many collisions

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Summary

INTRODUCTION

Carrier transport in extended conductors is an inherently semiclassical phenomenon, requiring an effective singleparticle description as well as averaging over real space and momentum space degrees of freedom. It is well established that a naive application of the semiclassical model to the anomalous and spin-Hall effects in disordered systems makes inaccurate predictions [54,55,56,57,58,59,60] and that the simple relaxation time approximation applied solely to the Boltzmann equation does not capture the full underlying physics of coherent scattering off the random disorder potential. We demonstrate that disorder affects the state occupation and the semiclassical equations of motion and that it generates a correction to the velocity that accounts for band mixing mediated by the Berry connection and disorder This approach enables one to distinguish disorder effects on the distribution function from disorder effects on carrier dynamics; yet it entails a change in one’s point of view so as to regard the semiclassical equations as describing carrier propagation averaged over many disorder scattering events.

MODEL HAMILTONIAN
QUANTUM KINETIC EQUATION
Kinetic equation in equilibrium
Adding an electric field
Kinetic equation and linear response
RECOVERING THE SEMICLASSICAL THEORY
LINEAR RESPONSE FAMILY TREE
APPLICATIONS
Spin density and spin-orbit torques in topological insulators
CONCLUSIONS AND OUTLOOK
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