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arXiv:2109.06563 · The Journal of Chemical Physics

A bosonic perspective on the classical mapping of fermionic quantum dynamics

Jing Sun, Sudip Sasmal, Oriol Vendrell

Published Oct 5, 2021• 9 citations
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Abstract

We consider the application of the original Meyer-Miller (MM) Hamiltonian to mapping fermionic quantum dynamics to classical equations of motion. Non-interacting fermionic and bosonic systems share the same one-body density dynamics when evolving from the same initial many-body state. The MM classical mapping is exact for non-interacting bosons, and therefore, it yields the exact time-dependent one-body density for non-interacting fermions as well. Starting from this observation, the MM mapping is compared to different mappings specific for fermionic systems, namely, the spin mapping with and without including a Jordan-Wigner transformation and the Li-Miller mapping (LMM). For non-interacting systems, the inclusion of fermionic anti-symmetry through the Jordan-Wigner transform does not lead to any improvement in the performance of the mappings, and instead, it worsens the classical description. For an interacting impurity model and for models of excitonic energy transfer, the MM and LMM mappings perform similarly, and in some cases, the former outperforms the latter when compared to a full quantum description. The classical mappings are able to capture interference effects, both constructive and destructive, that originate from equivalent energy transfer pathways in the models.

DOI
10.1063/5.0066740

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We consider the application of the original Meyer-Miller (MM) Hamiltonian to mapping fermionic quantum dynamics to classical equations of motion. Non-interacting fermionic and bosonic systems share the same one-body density dynamics when evolving from the same initial many-body state. The MM classical mapping is exact for non-interacting bosons, and therefore, it yields the exact time-dependent one-body density for non-interacting fermions as well. Starting from this observation, the MM mapping is compared to different mappings specific for fermionic systems, namely, the spin mapping with and without including a Jordan-Wigner transformation and the Li-Miller mapping (LMM). For non-interacting systems, the inclusion of fermionic anti-symmetry through the Jordan-Wigner transform does not lead to any improvement in the performance of the mappings, and instead, it worsens the classical description. For an interacting impurity model and for models of excitonic energy transfer, the MM and LMM mappings perform similarly, and in some cases, the former outperforms the latter when compared to a full quantum description. The classical mappings are able to capture interference effects, both constructive and destructive, that originate from equivalent energy transfer pathways in the models.
We present a strategy for mapping the dynamics of a fermionic quantum system to a set of classical dynamical variables. The approach is based on imposing the correspondence relation between the commutator and the Poisson bracket, preserving Heisenberg's equation of motion for one-body operators. In order to accommodate the effect of two-body terms, we further impose quantization on the spin-dependent occupation numbers in the classical equations of motion, with a parameter that is determined self-consistently. Expectation values for observables are taken with respect to an initial quasiclassical distribution that respects the original quantization of the occupation numbers. The proposed classical map becomes complete under the evolution of quadratic Hamiltonians and is extended for all even order observables. We show that the map provides an accurate description of the dynamics for an interacting quantum impurity model in the coulomb blockade regime, at both low and high temperatures. The numerical results are aided by a novel importance sampling scheme that employs a reference system to reduce significantly the sampling effort required to converge the classical calculations.
We present a strategy for mapping the dynamics of a fermionic quantum system to a set of classical dynamical variables. The approach is based on imposing the correspondence relation between the commutator and the Poisson bracket, preserving Heisenberg's equation of motion for one-body operators. In order to accommodate the effect of two-body terms, we further impose quantization on the spin-dependent occupation numbers in the classical equations of motion, with a parameter that is determined self-consistently. Expectation values for observables are taken with respect to an initial quasiclassical distribution that respects the original quantization of the occupation numbers. The proposed classical map becomes complete under the evolution of quadratic Hamiltonians and is extended for all even order observables. We show that the map provides an accurate description of the dynamics for an interacting quantum impurity model in the coulomb blockade regime, at both low and high temperatures. The numerical results are aided by a novel importance sampling scheme that employs a reference system to reduce significantly the sampling effort required to converge the classical calculations.
We propose a new unified theoretical framework to construct equivalent representations of the multi-state Hamiltonian operator and present several approaches for the mapping onto the Cartesian phase space. After mapping an F-dimensional Hamiltonian onto an F+1 dimensional space, creation and annihilation operators are defined such that the F+1 dimensional space is complete for any combined excitation. Commutation and anti-commutation relations are then naturally derived, which show that the underlying degrees of freedom are neither bosons nor fermions. This sets the scene for developing equivalent expressions of the Hamiltonian operator in quantum mechanics and their classical/semiclassical counterparts. Six mapping models are presented as examples. The framework also offers a novel way to derive such as the well-known Meyer-Miller model.
Given a time-independent Hamiltonian H~\widetilde HH , one can construct a time-dependent Hamiltonian HtH_tHt​ by means of the gauge transformation Ht=UtH~Ut†−iUt∂tUt†H_t=U_t\kern1pt \widetilde H \kern1pt U^\dagger_t-i\kern1pt U_t\kern1pt\partial_t U_t^\daggerHt​=Ut​HUt†​−iUt​∂t​Ut†​ . Here UtU_tUt​ is the unitary transformation that relates the solutions of the corresponding Schrödinger equations. In the many-body case one is usually interested in Hamiltonians with few-body (often, at most two-body) interactions. We refer to such Hamiltonians as physical. We formulate sufficient conditions on UtU_tUt​ ensuring that HtH_tHt​ is physical as long as H~\widetilde HH is physical (and vice versa). This way we obtain a general method for finding pairs of physical Hamiltonians HtH_tHt​ and H~\widetilde HH such that the driven many-body dynamics governed by HtH_tHt​ can be reduced to the quench dynamics due to the time-independent H~\widetilde HH . We apply this method to a number of many-body systems. First we review the mapping of a spin system with isotropic Heisenberg interaction and arbitrary time-dependent magnetic field to a time-independent system without a magnetic field [F. Yan, L. Yang, and B. Li, Phys. Lett. A 251, 289–293; 259, 207–211 (1999)]. Then we demonstrate that essentially the same gauge transformation eliminates an arbitrary time-dependent magnetic field from a system of interacting fermions. Further, we apply the method to the quantum Ising spin system and a spin coupled to a bosonic environment. We also discuss a more general situation where H~=H~t\widetilde H = \widetilde H_tH=Ht​ is time-dependent but dynamically integrable.
The Jordan-Wigner transformation permits one to convert spin 1/2 operators into spinless fermion ones, or vice versa. In some cases, it transforms an interacting spin Hamiltonian into a noninteracting fermionic one, which is exactly solved at the mean-field level. Even when the resulting fermionic Hamiltonian is interacting, its mean-field solution can provide surprisingly accurate energies and correlation functions. Jordan-Wigner is, however, only one possible means of interconverting spin and fermionic degrees of freedom. Here, we apply several such techniques to the XXZ and J1-J2 Heisenberg models, as well as to the pairing or reduced Bardeen-Cooper-Schrieffer Hamiltonian, with the aim of discovering which of these mappings is most useful in applying fermionic mean-field theory to the study of spin Hamiltonians.
We revisit the Jordan–Wigner transformation, showing that—rather than a non-local isomorphism between different fermionic and spin Hamiltonian operators—it can be viewed in terms of local identities relating different realizations of projection operators. The construction works for arbitrary dimension of the ambient lattice, as well as of the on-site vector space, generalizing Jordan–Wigner's result. It provides a direct mapping of local quantum spin problems into local fermionic problems (and vice versa), under the (rather physical) requirement that the latter are described by Hamiltonians which are even products of fermionic operators. As an application, we specialize to mappings between constrained-fermion models and spin-1 models on chains, obtaining in particular some new integrable spin Hamiltonian, and the corresponding ground-state energies.