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arXiv:2610.18970

Programmable Polaron Models and Tomography in Trapped-Ion Quantum Simulators

Filip Marijanovic, Utso Bhattacharya, Abhishek Menon, Visal So, Guido Pagano, Eugene Demler

quant-phcond-mat.quant-gascond-mat.str-elSubmitted Oct 13, 2026• Announced Oct 15, 2026• 0 citations
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Abstract

Strong coupling between mobile charge carriers or excitons and lattice vibrations gives rise to polarons: quasiparticles formed by charge carriers dressed by a cloud of phonon excitations. Polaron formation determines transport properties of systems ranging from transition-metal oxides and organic semiconductors to light-harvesting complexes. In excitonic systems that admit a hard-core boson description, mapping the excitations to pseudospins provides a natural framework for studying polaron physics, including the nonperturbative regime in which hopping amplitudes, phonon energies, and coupling strengths are comparable. Here, we propose a trapped-ion blueprint for realizing spin-phonon Hamiltonians with programmable spatial coupling between excitation density and phonon displacements, encompassing local Holstein and long-range Fröhlich-type interactions. To access strongly dressed quasiparticles whose bare spectral weight is suppressed, we introduce displaced Green's functions implemented through spin-dependent phonon displacements. Their spectral response reveals the polaron band spectrum, including binding energies and phonon-excitation sidebands, while spatially resolved measurements probe the structure of the phonon dressing cloud, providing a route to polaron tomography. We further complement this spectroscopy with direct and ancilla-assisted measurements of spin-phonon correlations that track the coupled dynamics of the excitation and its environment. These approaches connect the emergent quasiparticle spectrum to the microscopic buildup of its dressing cloud, enabling controlled studies of how the spatial range of coupling shapes polaron formation and mobility.

Comments
18 pages, 3 pages Appendix, 9 pages Supplement, 8 Figures

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In this thesis, we investigated the spectral properties of polaronic quasiparticles resulting from the coupling of a charge carrier to the bosonic excitations of ordered environments. Holstein polarons, describing an electron locally coupled to dispersionless phonons, and spin polarons in hole-doped antiferromagnets are considered. The Green's function of the Holstein polaron in a lattice with various kinds of impurities is calculated using the momentum average approximation. The main finding is that the scenario where the mere effect of the coupling to phonons is to enhance the electron's effective mass is incomplete as the phonons are found to also renormalize the impurity potential the polaron interacts with. This formalism is applied first to the case of a single impurity and the range of parameters where the polaron's ground state is localized is identified. The lifetime of the polaron due to scattering from weak but extended disorder is then studied and it is shown that the renormalization of the disorder potential leads to deviation of the strong coupling results from Fermi's golden rule's predictions. Motivated by the hole-doped cuprate superconductors, the motion of a hole in a two-dimensional Ising antiferromagnet and its binding to an attractive impurity is studied next, based on a variational scheme that allows for configurations with a certain maximum number of spin flips. The role of the magnetic sublattices in determining the symmetry of the resulting bound states is discussed. Next, a more realistic model describing a hole in a CuO₂ layer which retains the O explicitly, is considered. By neglecting the fluctuations of the Cu spins and using a variational principle similar to that of the previous chapter, a semi-analytic solution for the Green's function of the hole in an infinite 2D lattice is constructed. The resulting quasiparticle dispersion shows the proper ground state and other features observed in experiments. The lack of importance of the background spin fluctuations is justified based on the hole's ability to move on the O sublattice without disturbing the Cu spins. Finally, the model is generalized to gauge the importance of other relevant O orbitals.

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Strong coupling between mobile charge carriers or excitons and lattice vibrations gives rise to polarons: quasiparticles formed by charge carriers dressed by a cloud of phonon excitations. Polaron formation determines transport properties of systems ranging from transition-metal oxides and organic semiconductors to light-harvesting complexes. In excitonic systems that admit a hard-core boson description, mapping the excitations to pseudospins provides a natural framework for studying polaron physics, including the nonperturbative regime in which hopping amplitudes, phonon energies, and coupling strengths are comparable. Here, we propose a trapped-ion blueprint for realizing spin-phonon Hamiltonians with programmable spatial coupling between excitation density and phonon displacements, encompassing local Holstein and long-range Fröhlich-type interactions. To access strongly dressed quasiparticles whose bare spectral weight is suppressed, we introduce displaced Green's functions implemented through spin-dependent phonon displacements. Their spectral response reveals the polaron band spectrum, including binding energies and phonon-excitation sidebands, while spatially resolved measurements probe the structure of the phonon dressing cloud, providing a route to polaron tomography. We further complement this spectroscopy with direct and ancilla-assisted measurements of spin-phonon correlations that track the coupled dynamics of the excitation and its environment. These approaches connect the emergent quasiparticle spectrum to the microscopic buildup of its dressing cloud, enabling controlled studies of how the spatial range of coupling shapes polaron formation and mobility.
The Holstein model, which describes purely local coupling of an itinerant excitation (electron, hole, exciton) with zero-dimensional (dispersionless) phonons, represents the paradigm for short-range excitation-phonon interactions. It is demonstrated here how spectral properties of small Holstein polarons -- heavily phonon-dressed quasiparticles, formed in the strong-coupling regime of the Holstein model -- can be extracted from an analog quantum simulator of this model. This simulator, which is meant to operate in the dispersive regime of circuit quantum electrodynamics, has the form of an array of capacitively coupled superconducting transmon qubits and microwave resonators, the latter being subject to a weak external driving. The magnitude of XYXYXY-type coupling between adjacent qubits in this system can be tuned through an external flux threading the SQUID loops between those qubits; this translates into an {\em in-situ} flux-tunable hopping amplitude of a fictitious itinerant spinless-fermion excitation, allowing one to access all the relevant physical regimes of the Holstein model. By employing the kernel-polynomial method, based on expanding dynamical response functions in Chebyshev polynomials of the first kind and their recurrence relation, the relevant single-particle momentum-frequency resolved spectral function of this system is computed here for a broad range of parameter values. To complement the evaluation of the spectral function, it is also explained how -- by making use of the many-body version of the Ramsey interference protocol -- this dynamical-response function can be measured in the envisioned analog simulator.
Polarons—quantum particles dressed by a cloud of bath excitations—arise whenever a particle interacts strongly with its host medium. Electron and hole polarons, formed when carriers bind to a phonon cloud through electron-phonon (e-ph) interactions, govern charge transport in transition metal oxides, organic semiconductors, and halide perovskites. The concept generalizes to exciton-phonon interactions, giving rise to exciton polarons that produce the large Stokes shifts and broad photoluminescence (PL) lineshapes central to light-emitting applications. A predictive treatment of polarons has remained elusive. Numerically exact methods such as diagrammatic Monte Carlo (DMC) have been restricted to simplified model Hamiltonians, while first-principles approaches based on density functional theory provide material-specific e-ph interactions but treat the e-ph correlation approximately. This thesis bridges that gap by developing first-principles diagrammatic Monte Carlo (FPDMC), which stochastically sums all e-ph Feynman diagrams using accurate ab-initio interactions, yielding numerically exact polaron properties in real materials. Two methodological advances make FPDMC possible. A matrix-product formalism sums over electronic band indices exactly, alleviating the multi-band sign problem in realistic band structures. A data-driven compression of e-ph interactions based on singular-value decomposition (SVD) in the Wannier basis then accelerates the method by more than 10³×. The SVD compression also reveals a hidden low-dimensional structure of quantum interactions, maintaining accuracy across charge transport, spin relaxation, band renormalization, and superconductivity calculations. Extending this philosophy to phonon-phonon interactions via a permanent CP (PCP) decomposition yields 10³–10⁴× compression of anharmonic force constants and orders-of-magnitude speedups in thermal conductivity calculations. Applying FPDMC, we study polarons in LiF, SrTiO₃, and TiO₂, finding excellent agreement with experimental mobilities and resolving the contrasting small- and large-polaron transport in the two TiO₂ polymorphs. To make the microscopic picture concrete, we introduce an e-ph correlation function that visualizes lattice distortion and polaron orbital character. Extending FPDMC to exciton polarons, we obtain first-principles exciton-phonon interactions from finite-momentum Bethe-Salpeter equation calculations and derive a Fermi-golden-rule PL theory. Applied to CrBr₃, FPDMC predicts a broad PL spectrum agreeing with experiment in both peak position and lineshape.
We have computed static and dynamic properties of an electron coupled to hard-core-boson (HCB) degrees of freedom in one spatial dimension. The polaron, an electron dressed with HCB excitations, remains light even in the strong-coupling limit as its effective mass remains of the order of the free-electron mass. This result is in a sharp contrast to the Holstein model where the electron effective mass increases exponentially with the electron-phonon coupling. HCB degrees of freedom mediate the attractive potential between two electrons that form a bound singlet bipolaron state at any nonzero coupling strength. In the low-frequency regime of the electron spectral function we observe a quasiparticle (QP) band that is separated from the continuum of states only in the central part of the Brillouin zone. The quasiparticle weight approaches zero as the QP band enters the continuum where it obtains a finite lifetime. At finite temperature an electron can annihilate thermally excited HCBs. Such thermally activated processes lead to a buildup of the spectral weight below the QP band. While the investigated model bears a resemblance with the Holstein model, we point out many important differences that originate from the binary HCB excitation spectrum, which in turn mimics spin-12\frac{1}{2}21​ degrees of freedom.
Spectroscopic measurements of single-particle spectral functions provide crucial insight into strongly correlated quantum matter by resolving the energy and spatial structure of elementary excitations. Here we introduce a spectroscopic protocol for single-charge injection with simultaneous spatial and energy resolution in a Rydberg tweezer array, effectively emulating scanning tunneling microscopy. By combining this protocol with single-atom-resolved imaging, we go beyond conventional spectroscopy by not only measuring the single-particle spectral function but also directly imaging the microscopic structure of the excitations underlying spectral resonances in frustrated tJtJtJ Hamiltonians. We reveal resonances associated with the formation of bound magnetic polarons -- composite quasiparticles consisting of a mobile hole bound to a magnon -- and directly extract their binding energy, spatial extent, and spin character. Finally, by exploiting the spatial tunability of our platform, we measure the local density of states across different lattice geometries. Our work establishes Rydberg tweezer arrays as a powerful platform for spectroscopic studies of strongly correlated models, offering microscopic control and direct real-space access to emergent quasiparticles in engineered quantum matter.
Quantum spin systems with kinetic constraints have become paradigmatic for exploring collective dynamical behavior in many-body systems. Here we discuss a facilitated spin system which is inspired by recent progress in the realization of Rydberg quantum simulators. This platform allows to control and investigate the interplay between facilitation dynamics and the coupling of spin degrees of freedom to lattice vibrations. Developing a minimal model, we show that this leads to the formation of polaronic quasiparticle excitations which are formed by many-body spin states dressed by phonons. We investigate in detail the properties of these quasiparticles, such as their dispersion relation, effective mass, and the quasiparticle weight. Rydberg lattice quantum simulators are particularly suited for studying this phonon-dressed kinetically constrained dynamics as their exaggerated length scales permit the site-resolved monitoring of spin and phonon degrees of freedom.
In this thesis, we investigated the spectral properties of polaronic quasiparticles resulting from the coupling of a charge carrier to the bosonic excitations of ordered environments. Holstein polarons, describing an electron locally coupled to dispersionless phonons, and spin polarons in hole-doped antiferromagnets are considered. The Green's function of the Holstein polaron in a lattice with various kinds of impurities is calculated using the momentum average approximation. The main finding is that the scenario where the mere effect of the coupling to phonons is to enhance the electron's effective mass is incomplete as the phonons are found to also renormalize the impurity potential the polaron interacts with. This formalism is applied first to the case of a single impurity and the range of parameters where the polaron's ground state is localized is identified. The lifetime of the polaron due to scattering from weak but extended disorder is then studied and it is shown that the renormalization of the disorder potential leads to deviation of the strong coupling results from Fermi's golden rule's predictions. Motivated by the hole-doped cuprate superconductors, the motion of a hole in a two-dimensional Ising antiferromagnet and its binding to an attractive impurity is studied next, based on a variational scheme that allows for configurations with a certain maximum number of spin flips. The role of the magnetic sublattices in determining the symmetry of the resulting bound states is discussed. Next, a more realistic model describing a hole in a CuO₂ layer which retains the O explicitly, is considered. By neglecting the fluctuations of the Cu spins and using a variational principle similar to that of the previous chapter, a semi-analytic solution for the Green's function of the hole in an infinite 2D lattice is constructed. The resulting quasiparticle dispersion shows the proper ground state and other features observed in experiments. The lack of importance of the background spin fluctuations is justified based on the hole's ability to move on the O sublattice without disturbing the Cu spins. Finally, the model is generalized to gauge the importance of other relevant O orbitals.