Publications

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• Accelerating equilibrium spin-glass simulations using quantum annealers via generative deep learning

  Giuseppe Scriva, Emanuele Costa, Benjamin McNaughton, Sebastiano Pilati

  SciPost Phys. 15, 018 (2023) · published 20 July 2023 | Toggle abstract · pdf

  Adiabatic quantum computers, such as the quantum annealers commercialized by D-Wave Systems Inc., are routinely used to tackle combinatorial optimization problems. In this article, we show how to exploit them to accelerate equilibrium Markov chain Monte Carlo simulations of computationally challenging spin-glass models at low but finite temperatures. This is achieved by training generative neural networks on data produced by a D-Wave quantum annealer, and then using them to generate smart proposals for the Metropolis-Hastings algorithm. In particular, we explore hybrid schemes by combining single spin-flip and neural proposals, as well as D-Wave and classical Monte Carlo training data. The hybrid algorithm outperforms the single spin-flip Metropolis-Hastings algorithm. It is competitive with parallel tempering in terms of correlation times, with the significant benefit of a much shorter equilibration time.

  1 citation

• Exceptional points in the Baxter-Fendley free parafermion model

  Robert A. Henry, Murray T. Batchelor

  SciPost Phys. 15, 016 (2023) · published 19 July 2023 | Toggle abstract · pdf

  Certain spin chains, such as the quantum Ising chain, have free fermion spectra which can be expressed as the sum of decoupled two-level fermionic systems. Free parafermions are a generalisation of this idea to $\mathbb{Z}_N$-symmetric clock models. In 1989 Baxter discovered a non-Hermitian but $\mathcal{PT}$-symmetric model directly generalising the Ising chain, which was later described by Fendley as a free parafermion spectrum. By extending the model's magnetic field parameter to the complex plane, it is shown that a series of exceptional points emerges, where the quasienergies defining the free spectrum become degenerate. An analytic expression for the locations of these points is derived, and various numerical investigations are performed. These exceptional points also exist in the Ising chain with a complex transverse field. Although the model is not in general $\mathcal{PT}$-symmetric at these exceptional points, their proximity can have a profound impact on the model on the $\mathcal{PT}$-symmetric real line. Furthermore, in certain cases an exceptional point may appear on the real line (with negative field).

  2 citations

• Universal Chern number statistics in random matrix fields

  Or Swartzberg, Michael Wilkinson, Omri Gat

  SciPost Phys. 15, 015 (2023) · published 19 July 2023 | Toggle abstract · pdf

  We investigate the probability distribution of Chern numbers (quantum Hall conductance integers) for a parametric version of the GUE random matrix ensemble, which is a model for a chaotic or disordered system. The numerically-calculated single-band Chern number statistics agree well with predictions based on an earlier study [O. Gat and M. Wilkinson, SciPost Phys., 10, 149, (2021)] of the statistics of the quantum adiabatic curvature, when the parametric correlation length is small. However, contrary to an earlier conjecture, we find that the gap Chern numbers are correlated, and that the correlation is weak but slowly-decaying. Also, the statistics of weighted sums of Chern numbers differs markedly from predictions based upon the hypothesis that gap Chern numbers are uncorrelated. All our results are consistent with the universality hypothesis described in the earlier paper, including in the previously unstudied regime of large correlation length, where the Chern statistics is highly non-Gaussian.

• Special transition and extraordinary phase on the surface of a two-dimensional quantum Heisenberg antiferromagnet

  Chengxiang Ding, Wenjing Zhu, Wenan Guo, Long Zhang

  SciPost Phys. 15, 012 (2023) · published 18 July 2023 | Toggle abstract · pdf

  Continuous phase transitions exhibit richer critical phenomena on the surface than in the bulk, because distinct surface universality classes can be realized at the same bulk critical point by tuning the surface interactions. The exploration of surface critical behavior provides a window looking into higher-dimensional boundary conformal field theories. In this work, we study the surface critical behavior of a two-dimensional (2D) quantum critical Heisenberg model by tuning the surface coupling strength, and discover a direct special transition on the surface from the ordinary phase into an extraordinary phase. The extraordinary phase has a long-range antiferromagnetic order on the surface, in sharp contrast to the logarithmic decaying spin correlations in the 3D classical O(3) model. The special transition point has a new set of critical exponents, $y_{s}=0.86(4)$ and $\eta_{\parallel}=-0.33(1)$, which are distinct from the special transition of the classical O(3) model and indicate a new surface universality class of the 3D O(3) Wilson-Fisher theory.

  3 citations

• Codebase release 1.1 for LinReTraCe

  Matthias Pickem, Emanuele Maggio, Jan M. Tomczak

  SciPost Phys. Codebases 16-r1.1 (2023) · published 17 July 2023 | Toggle abstract · src

  We describe the "Linear Response Transport Centre" (LinReTraCe), a package for the simulation of transport properties of solids. LinReTraCe captures quantum (in)coherence effects beyond semi-classical Boltzmann techniques, while incurring similar numerical costs. The enabling algorithmic innovation is a semi-analytical evaluation of Kubo formulae for resistivities and the coefficients of Hall, Seebeck and Nernst. We detail the program's architecture, its interface and usage with electronic-structure packages such as WIEN2k, VASP, and Wannier90, as well as versatile tight-binding settings.

  1 citation

• LinReTraCe: The linear response transport centre

  Matthias Pickem, Emanuele Maggio, Jan M. Tomczak

  SciPost Phys. Codebases 16 (2023) · published 17 July 2023 | Toggle abstract · pdf

  We describe the "Linear Response Transport Centre" (LinReTraCe), a package for the simulation of transport properties of solids. LinReTraCe captures quantum (in)coherence effects beyond semi-classical Boltzmann techniques, while incurring similar numerical costs. The enabling algorithmic innovation is a semi-analytical evaluation of Kubo formulae for resistivities and the coefficients of Hall, Seebeck and Nernst. We detail the program's architecture, its interface and usage with electronic-structure packages such as WIEN2k, VASP, and Wannier90, as well as versatile tight-binding settings.

  2 citations

• Electronic excitations of the charged nitrogen-vacancy center in diamond obtained using time-independent variational density functional calculations

  Aleksei V. Ivanov, Yorick L. A. Schmerwitz, Gianluca Levi, Hannes Jónsson

  SciPost Phys. 15, 009 (2023) · published 13 July 2023 | Toggle abstract · pdf

  Elucidation of the mechanism for optical spin initialization of point defects in solids in the context of quantum applications requires an accurate description of the excited electronic states involved. While variational density functional calculations have been successful in describing the ground state of a great variety of systems, doubts have been expressed in the literature regarding the ability of such calculations to describe electronic excitations of point defects. A direct orbital optimization method is used here to perform time-independent, variational density functional calculations of a prototypical defect, the negatively charged nitrogen-vacancy center in diamond. The calculations include up to 511 atoms subject to periodic boundary conditions and the excited state calculations require similar computational effort as ground state calculations. Contrary to some previous reports, the use of local and semilocal density functionals gives the correct ordering of the low-lying triplet and singlet states, namely ${}^{3}A_2 < {}^{1}E < {}^{1}A_1 < {}^{3}E$. Furthermore, the more advanced meta generalized gradient approximation functionals give results that are in remarkably good agreement with high-level, many-body calculations as well as available experimental estimates, even for the excited singlet state which is often referred to as having multireference character. The lowering of the energy in the triplet excited state as the atom coordinates are optimized in accordance with analytical forces is also close to the experimental estimate and the resulting zero-phonon line triplet excitation energy is underestimated by only 0.15 eV. The approach used here is found to be a promising tool for studying electronic excitations of point defects in, for example, systems relevant for quantum technologies.

  3 citations

• Exact one-particle density matrix for SU(N) fermionic matter-waves in the strong repulsive limit

  Andreas Osterloh, Juan Polo, Wayne J. Chetcuti, Luigi Amico

  SciPost Phys. 15, 006 (2023) · published 11 July 2023 | Toggle abstract · pdf

  We consider a gas of repulsive $N$-component fermions confined in a ring-shaped potential, subjected to an effective magnetic field. For large repulsion strengths, we work out a Bethe ansatz scheme to compute the two-point correlation matrix and then the one-particle density matrix. Our results hold in the mesoscopic regime of finite but sufficiently large number of particles and system size that are not accessible by numerics. We access the momentum distribution of the system and analyse its specific dependence of interaction, magnetic field and number of components $N$. In the context of cold atoms, the exact computation of the correlation matrix to determine the interference patterns that are produced by releasing cold atoms from ring traps is carried out.

• Analysis of radiation damage in silicon charge-coupled devices used for dark matter searches

  Steven J. Lee

  SciPost Phys. Proc. 12, 030 (2023) · published 4 July 2023 | Toggle abstract · pdf

  Nuclear recoils in crystal detectors generate radiation damage in the form of crystal defects that can be measured in scientific-grade CCDs as local hot spots of leakage current stimulated by temperature increases in the devices. In this proceeding, we use a neutron source to generate defects in DAMIC-M CCDs, and using increases in leakage current at different temperatures, we demonstrate a procedure for identifying crystal defects in the CCDs of the DAMIC-M experiment. This is the first time that individual defects generated from nuclear recoils have been studied. This technique could be used to distinguish nuclear recoils from electron recoils in some energy ranges, which would improve the ability of CCD detectors to search for weakly interacting dark matter.

  1 citation

• Quantum local random networks and the statistical robustness of quantum scars

  Federica Maria Surace, Marcello Dalmonte, Alessandro Silva

  SciPost Phys. 14, 174 (2023) · published 29 June 2023 | Toggle abstract · pdf

  We investigate the emergence of quantum scars in a general ensemble of random Hamiltonians (of which the PXP is a particular realization), that we refer to as quantum local random networks. We find a class of scars, that we call "statistical", and we identify specific signatures of the localized nature of these eigenstates by analyzing a combination of indicators of quantum ergodicity and properties related to the network structure of the model. Within this parallelism, we associate the emergence of statistical scars to the presence of "motifs" in the network, that reflects how these are associated to links with anomalously small connectivity. Most remarkably, statistical scars appear at well-defined values of energy, predicted solely on the base of network theory. We study the scaling of the number of statistical scars with system size: by continuously changing the connectivity of the system we find that there is a transition from a regime where the constraints are too weak for scars to exist for large systems to a regime where constraints are stronger and the number of statistical scars increases with system size. This allows to define the concept of "statistical robustness" of quantum scars.

  2 citations