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arXiv:2203.08044 · Journal of Mathematical Physics

From charge to spin: Analogies and differences in quantum transport coefficients

Giovanna Marcelli, Domenico Monaco

Published Jul 1, 2022• 5 citations
arXivHTMLPDF

Abstract

We review some recent results from the mathematical theory of transport of charge and spin in gapped crystalline quantum systems. The emphasis will be on transport coefficients, such as conductivities and conductances. As for the former, those are computed as appropriate expectations of current operators in a non-equilibrium almost-stationary state (NEASS), which arises from the perturbation of an equilibrium state by an external electric field. While for charge transport the usual double-commutator Kubo formula is recovered (also beyond linear response), we obtain formulas for appropriately defined spin conductivities, which are still explicit but more involved. Certain “Kubo-like” terms in these formulas are also shown to agree with the corresponding contributions to the spin conductance. In addition to that, we employ similar techniques to show a new result, namely that even in systems with non-conserved spin, there is no generation of spin torque, that is, the spin torque operator has an expectation in the NEASS which vanishes faster than any power of the intensity of the perturbing field.

DOI
10.1063/5.0089786

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We review some recent results from the mathematical theory of transport of charge and spin in gapped crystalline quantum systems. The emphasis will be on transport coefficients, such as conductivities and conductances. As for the former, those are computed as appropriate expectations of current operators in a non-equilibrium almost-stationary state (NEASS), which arises from the perturbation of an equilibrium state by an external electric field. While for charge transport the usual double-commutator Kubo formula is recovered (also beyond linear response), we obtain formulas for appropriately defined spin conductivities, which are still explicit but more involved. Certain “Kubo-like” terms in these formulas are also shown to agree with the corresponding contributions to the spin conductance. In addition to that, we employ similar techniques to show a new result, namely that even in systems with non-conserved spin, there is no generation of spin torque, that is, the spin torque operator has an expectation in the NEASS which vanishes faster than any power of the intensity of the perturbing field.
We first review the problem of a rigorous justification of Kubo’s formula for transport coefficients in gapped extended Hamiltonian quantum systems at zero temperature. In particular, the theoretical understanding of the quantum Hall effect rests on the validity of Kubo’s formula for such systems, a connection that we review briefly as well. We then highlight an approach to linear response theory based on non-equilibrium almost-stationary states (NEASS) and on a corresponding adiabatic theorem for such systems that was recently proposed and worked out by one of us in [51] for interacting fermionic systems on finite lattices. In the second part of our paper, we show how to lift the results of [51] to infinite systems by taking a thermodynamic limit.
In this note we consider lattice fermions on Z2 with a locally unique gapped ground state and show how to apply the non-equilibrium almost stationary state (NEASS) approach to linear response to derive a formula for the Hall conductance in terms of the ground state expectation of a commutator of modified step functions. This formula is usually derived by a charge pumping argument going back to Laughlin. Here we show that it can also be obtained as the linear response coefficient of the microscopic current response to an adiabatic increase of the chemical potential on a half plane (or more generally on any cone-like region). Indeed, in a manner reminiscent of the bulk-boundary correspondence, we show that raising the chemical potential in any cone-like region gives rise to a current that flows along its boundary and is nearly linear in the increase in chemical potential. We also discuss the connection with the double commutator formula with modified position operators for the Hall conductivity derived in [Wesle et al., Commun. Math. Phys. 406, 199 (2025)] as the linear response coefficient of the macroscopic current response to the adiabatic application of a constant electric field.
We derive a Kubo-type formula that describes proper non-equilibrium stationary states for finite-size systems. We first argue that the usual Kubo formula considers only equilibrium states of the perturbed system, which are inappropriate to describe transport properties. Moreover, we show that the standard Kubo formula for the dc conductance is only appropriate in the thermodynamic limit. We demonstrate that taking into consideration explicitly the coupling to the leads/baths solves both problems. This approach results in well-behaved response functions, without the singular contributions from degenerate states encountered when Kubo formulae for infinite-size systems are inappropriately used for finite-size systems. We also derive a second, more efficient formulation which is valid only for a set of special physical quantities, which includes the charge current density operator.
The study of electrical currents in a regime where a description as a continuous flow fails and the particle nature becomes important, but where notions such as particle density or currents continue to be meaningful, will be at the heart of the present dissertation. Given such a mesoscopic system through which electrons flow, either actively through quantum pumping or passively due to a potential difference, we investigate quantities such as transferred charge, noise, current fluctuations, and relations between them. More generally we shall examine the statistics of particle transport. All discussions will concentrate on compact devices transferring charge between two one-dimensional reservoirs (the leads) of independent electrons. Firstly, we consider the generating function of the moments of transferred charge and we prove that it is given by the determinant of a single-particle operator. It is formally equivalent to a formula of Lesovik and Levitov, but is shown to be well-defined in the situations under consideration, whereas the former is not, in general. The mechanism leading to regularization is typical for mesoscopic systems: we consider a limiting case that reveals the fundamental structure of the problem. In fact, as suited for an open system, the leads contain an infinite number of charges. It follows mathematically that the second quantization ought to be carried out upon the Fermi sea and not upon the vacuum, a procedure known as the GNS construction. We shall rely heavily on operator algebraic techniques. The set of observables, the C*-algebra of canonical anticommutation relations, admits different representations for systems in the thermodynamic limit, which are described by their reduced one-particle density matrix. An important question will be the existence of operators such as the charge or the time evolution in a given representation, which induce so-called Bogoliubov transformations. These prerequisites at hand, we shall pose the problem of counting statistics clearly, prove that the regularized determinant emerges naturally, and show that it describes the transport of integer charges with non-negative probabilities. Secondly, we introduce a model of instantaneous scattering in which various examples can be computed explicitely. In particular, we show that the above theorem applies for scattering through a smoothly operating pump over a finite time interval. We also exhibit situations where the propagator does exist but the generating function is ambiguous. In a more computational approach, we then turn to the relation of individual moments of transferred charge to current correlators. It turns out that the former can indeed be expressed as integrals of the latter over time, provided the current operators are ordered according to Matthews’ T∗ ordering. It is given by first arranging the charge operators according to their time indices, and only then taking the time derivatives, which induce contact terms whose singular support lies along time coincidences. We shall give two derivations of this result, because the first one is transparent, and the second one is related to contradictory computations in the literature where the system is considered to be measured by an external spin. In the model of constant instantaneous scattering, we then argue from the Lesovik-Levitov determinant that the transport can be interpreted in terms of a binomial process in the long time limit. In a parallel computation, we concentrate on the third cumulant as defined by integration of current correlators and show how the contact terms of the T∗ ordering play an essential role in providing the expected binomial result, too. To close this thesis, we suggest an algebraic framework that lays the foundations for a rigorous discussion of the Casimir effect. The problem of infinites arising in the comparison of two physical situations for a bosonic field is interpreted as the non-equivalence of states on the algebra of canonical commutation relations. We exhibit sufficient conditions on the one-particle Hamiltonians which ensure that the Casimir energy is finite and give an expression for it. We discuss its formal equivalence with the result obtained from the standard mode summing method.
In this paper, Non-Equilibrium Steady State that is induced by electric field and the conductivity of non-interacting fermion systems under the dissipative dynamics is discussed. The dissipation is taken into account within a framework of the quantum dynamical semigroup introduced by Davies (1977). We obtain a formula of the conductivity for the stationary state, which is applicable to arbitrary potentials. Our formula gives a justification of an adiabatic factor that is often introduced in practical calculation while using the Kubo formula. In addition, the conductivity of crystals (i.e., periodic potentials) is also discussed.
We address the question of whether transport coefficients obtained from a unitary closed system setting, i.e., the standard equilibrium Green-Kubo formula, are the same as the ones obtained from a weakly driven nonequilibrium steady-state calculation. We first derive a nonequilibrium Kubo-like expression for the steady-state diffusion constant expressed as a time integral of either a current or a conserved density nonequilibrium correlation function. This expression has certain advantages over the equilibrium Green-Kubo formula, but it is not clear if it gives the same value of the diffusion constant. We then rigorously show that if the unitary dynamics is diffusive, the nonequilibrium formula indeed gives exactly the same transport coefficient. The form of finite-size correction is also predicted. Theoretical results are verified by an explicit calculation of the diffusion constant in several interacting many-body models.