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arXiv:1411.2576 · Journal of Physics A Mathematical and Theoretical

Quantum Boltzmann equation for spin-dependent reactions in the kinetic regime

Martin L R Fürst, Markus Kotulla, Christian B. Mendl, Herbert E. Spohn

Published Feb 10, 2015• 2 citations
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Abstract

We derive and analyze an effective quantum Boltzmann equation in the kinetic regime for the interactions of four distinguishable types of fermionic spin- particles, starting from a general quantum field Hamiltonian. Each particle type is described by a time-dependent, 2 × 2 spin-density ('Wigner') matrix. We show that density and energy conservation laws as well as the H-theorem hold, and enumerate additional conservation laws depending on the interaction. The conserved quantities characterize the thermal (Fermi–Dirac) equilibrium state. We illustrate the approach to equilibrium by numerical simulations in the isotropic three-dimensional setting.

DOI
10.1088/1751-8113/48/9/095204

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We derive and analyze an effective quantum Boltzmann equation in the kinetic regime for the interactions of four distinguishable types of fermionic spin- particles, starting from a general quantum field Hamiltonian. Each particle type is described by a time-dependent, 2 × 2 spin-density ('Wigner') matrix. We show that density and energy conservation laws as well as the H-theorem hold, and enumerate additional conservation laws depending on the interaction. The conserved quantities characterize the thermal (Fermi–Dirac) equilibrium state. We illustrate the approach to equilibrium by numerical simulations in the isotropic three-dimensional setting.
We study the Boltzmann transport equation for the Bose-Hubbard chain in the kinetic regime. The time-dependent Wigner function is matrix-valued with odd dimension due to integer spin. For nearest neighbor hopping only, there are infinitely many additional conservation laws and nonthermal stationary states. Adding longer-range hopping amplitudes entails exclusively thermal equilibrium states. Especially for small next-nearest neighbor hopping amplitudes, we observe prethermalization with two time scales, which can be related to the relative strength of the nearest and next-nearest hopping. We provide a derivation of the Boltzmann equation based on the Hubbard Hamiltonian, including general interactions beyond on-site, and illustrate the results by numerical simulations.
We generalize our previous work on the compatibilty of kinetic equations with second virial corrections to the inclusion of spin and particle indistinguishability; the system is supposed to be sufficiently dilute for higher order virial density corrections (interactions and statistics) to be negligible. We show that the general idea of the “free Winger transform” can be extended to this situation; the function which appears in the kinetic equation becomes here a matrix which acts in the space of spin states of the particles. Assuming that the collisions are described by a hamiltonian which does not act on the spins (a very good approximation for nuclear spins), we write explicitly a kinetic equation which is valid for this case. The right hand side of the equation is an 18 dimension integral, as for spinless distinguishable particles, but here it contains an additional term due to statistics, which introduces commutators and anticommutators. We discuss the local conservation laws in this formalism and find, as expected, a total number of 8 conserved quantities for spin 1/2 particles (including three components of the magnetization). When the gas is at equilibrium, we obtain a pressure dependence which is in agreement with known calculations on spin polarized gases. We finally study the gradient expansion of the collision integral, and show that the zero-order (local) part is identical with the 4 terms (including identical spin rotation terms) obtained previously by Lhuillier et al. The first order (non-local) part contains many terms, wich we compare with those obtained by Silin in a context more closely related to the Landau theory.
We study, both analytically and numerically, the Boltzmann transport equation for the Hubbard chain with nearest-neighbor hopping and spatially homogeneous initial condition. The time-dependent Wigner function is matrix-valued because of spin. The H theorem holds. The nearest-neighbor chain is integrable, which, on the kinetic level, is reflected by infinitely many additional conservation laws and linked to the fact that there are also nonthermal stationary states. We characterize all stationary solutions. Numerically, we observe an exponentially fast convergence to stationarity and investigate the convergence rate in dependence on the initial conditions.
In the framework of real-time Green's functions, the general kinetic equations are investigated in a first-order gradient expansion. Within this approximation, the problem of the reconstruction of the two-time correlation functions from the one-time Wigner function was solved. For the Wigner function, a cluster expansion is found in terms of a quasiparticle distribution function. In equilibrium, this expansion leads to the well-known generalized Beth-Uhlenbeck expression of the second virial coefficient. As a special case, the T-matrix approximation for the self-energy is investigated. The quantum kinetic equation derived thus has, besides the (Markovian) Boltzmann collision integral, additional terms due to the retardation expansion which reflect memory effects. Special interest is paid to the case that bound states exist in the system. It is shown that the bound state contribution, which can be introduced via a bilinear expansion of the two-particle T matrix, follows from the first-order retardation term in the general kinetic equation. The full Wigner function is now a sum of one function describing the unbound particles and another one for the bound state contribution. The latter two functions have to be determined from a coupled set of kinetic equations. In contrast to the quantum Boltzmann equation, energy and density of a nonideal system are conserved. \textcopyright{} 1996 The American Physical Society.
We investigate the potential of a quantum Boltzmann equation without momentum conservation, i.e., a kinetic equation for the local distribution function, for describing correlated electron systems out of equilibrium. The equation can be derived either for the dynamics of well-defined quasi- particles, neglecting the momentum conservation of the scattering in the spirit of dynamical mean field theory (DMFT), or, equivalently, as the quantum Boltzmann equation for the local occupied density of states in non-equilibrium DMFT. The approach may thus be applied even in cases where well-defined quasiparticles do not exist, with the main assumption that the spectral function remains rigid under the non-equilibrium evolution. We compare the result of the Boltzmann equation to non-equilibrium DMFT for the case of photo-carrier relaxation in Mott insulators, where processes on very different timescales emerge, i.e., impact ionization, intra-Hubbard-band thermalization, and full thermalization. Since the Boltzmann without momentum conservation is much simpler, it may allow us to simulate more complicated systems, whole devices, and much longer times.
The inversion method to derive the quantum kinetic equation is extended to the case of an inhomogeneous system. Within the closed-time-path formalism, the source is introduced to probe the (Fourier transform of the) Wigner distribution function and the equation of motion for the Wigner function is derived perturbatively by the inversion formulae. The equation of motion has the form of the generalized Boltzmann equation, which is non-local in space and time. For the obtained kinetic equation, the local conservation laws of number, energy and momentum are confirmed.