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DOE OSTI2020

Chiral Instabilities and the Onset of Chiral Turbulence in QED Plasmas

We present a first principles study of chiral plasma instabilities and the onset of chiral turbulence in QED plasmas with strong gauge matter interaction ( e 2 N f = 64 ), far from equilibrium. By performing classical-statistical lattice simulations of the microscopic theory, we show that the generation of strong helical magnetic fields from a helicity imbalance in the fermion sector proceeds via three distinct phases. During the initial linear instability regime the helicity imbalance of the fermion sector causes an exponential growth (damping) of magnetic field modes with right- (left-) handed polarization, for which we extract the characteristic growth (damping) rates. Secondary growth of unstable modes accelerates the helicity transfer from fermions to gauge fields and ultimately leads to the emergence of a self-similar scaling regime characteristic of a decaying turbulence, where magnetic helicity is efficiently transferred to macroscopic length scales. Within this turbulent regime, the evolution of magnetic helicity spectrum can be described by an infrared power spectrum with spectral exponent κ = 10.2 ± 0.5 and dynamical scaling exponents α = 1.14 ± 0.50 and β = 0.37 ± 0.13 .

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

DOE OSTI2025

Strong Electromagnetic Fields in Heavy Ion Collisions

Photons play a pivotal role in both theoretical and applied physics, ranging from elementary particle studies to practical technologies. This article explores how ultra-peripheral collisions of heavy ions act as sources of nearly real photons, enabling the investigation of a wide range of photon-induced processes. By applying the equivalent photon approximation, one can study nuclear structure, QED phenomena, and potential new physics, all in a backgroundsuppressed environment.

Bertulani, C. A. [East Texas A & M Univ., Commerce↗

DOE OSTI2026

Tensor network simulations of quasi-GPDs in the massive Schwinger model

Generalized parton distribution functions (GPDs) are off-diagonal light-cone matrix elements that encode the internal structure of hadrons in terms of quark and gluon degrees of freedom. In this work, we present the first nonperturbative study of quasi-GPDs in the massive Schwinger model, quantum electrodynamics in 1+1 dimensions (QED 2 ), within the Hamiltonian formulation of lattice field theory. Quasidistributions are spatial correlation functions of boosted states, which approach the relevant light-cone distributions in the luminal limit. Using tensor networks, we prepare the first excited state in the strongly coupled regime and boost it to close to the light-cone on lattices of up to 400 lattice sites. We compute both quasiparton distribution functions and, for the first time, quasi-GPDs, and study their convergence for increasingly boosted states. In addition, we perform analytic calculations of GPDs in the two-particle Fock-space approximation and in the Reggeized limit, providing qualitative benchmarks for the tensor network results. Our analysis establishes computational benchmarks for accessing partonic observables in low-dimensional gauge theories, offering a starting point for future extensions to higher dimensions, non-Abelian theories, and quantum simulations.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

DOE OSTI2024

A precise electron EDM constraint on CP-odd heavy-quark Yukawas

CP-odd Higgs couplings to bottom and charm quarks arise in many extensions of the standard model and are of potential interest for electroweak baryogenesis. These couplings induce a contribution to the electron EDM. The experimental limit on the latter then leads to a strong bound on the CP-odd Higgs couplings. We point out that this bound receives large QCD corrections, even though it arises from a leptonic observable. We calculate the contribution of CP-odd Higgs couplings to the bottom and charm quarks in renormalisation-group improved perturbation theory at next-to-leading order in the strong interaction, thereby reducing the uncertainty to a few percent.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

DOE OSTI2025

Perspective on Many-Body Methods for Molecular Polaritonic Systems

Recent advances in strong light–matter interactions have revealed a wealth of new physical phenomena in molecules embedded in optical cavities, including modified chemical reactivity, altered excitation spectra, and novel quantum correlations. To describe these effects from first-principles, the field of ab initio quantum electrodynamics (QED) has emerged as a compelling extension of quantum chemistry that treats electronic and photonic degrees of freedom on equal footing. In this Perspective, we review the growing landscape of many-body QED methods, including Hartree–Fock, density functional theory (QEDFT), time-dependent DFT (QED-TDDFT), configuration interaction (QED-CI), complete active space (QED-CASSCF), coupled cluster (QED-CC), quantum Monte Carlo (QED-QMC), and density matrix renormalization group (QED-DMRG), highlighting recent developments and implementations. We further explore real-time methods, gradient and Hessian formalisms, and the integration of nonadiabatic nuclear dynamics. Applications range from benchmark simulations of polaritonic chemistry to quantum simulations on emerging quantum hardware. We conclude by outlining future directions for theory development and interdisciplinary efforts at the interface of quantum chemistry, condensed matter, and quantum optics.

36 MATERIALS SCIENCE↗

DOE OSTI2024

Corrected calculation for the non-local solution to the g − 2 anomaly and novel results in non-local QED

We provide the corrected calculation of the (g − 2) μ in non-local QED previously done in the literature. In specific, we show the proper technique for calculating loops in non-local QED and use it to find the form factors F 1 (q 2 ) and F 2 (q 2 ) in non-local QED. We also utilize this technique to calculate some novel results in non-local QED, including calculating the correction to the photon self-energy, the modification to the classical Coulomb potential, the modification to the energy levels of the hydrogen atom, and the contribution to the Lamb shift. We also discuss charge dequantization through non-locality, and show that the experimental bounds on the electric charge on Dirac neutrinos, translate into strong flavor-dependent bounds on the scale on non-locality that range between 10 5 −10 10 TeV. We also discuss the inconsistencies of unrenormalized non-local Quantum Field Theories (QFTs) and the need for renormalizing them, even when they are free from UV divergences.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

DOE OSTI2021

Excitation dynamics in galvanically coupled fluxonium circuits

We propose a near-term quantum simulator based on the fluxonium qubits galvanically coupled to form a chain. This system provides long coherence time, large anharmonicity, and strong coupling, making it suitable to study strongly interacting Ising spin models. At half-flux quantum sweet spot, the system is described by the transverse field Ising model (TFIM). We evaluate the propagation of qubit excitations through the system. As disorder increases, the excitations become localized. A single qubit measurement using the circuit QED methods is sufficient to identify localization transition without introducing tunable couplers. We argue that galvanically coupled fluxoniums provide opportunities to study localization and many-body effects in highly coherent quantum systems.

Ozguler, A. Baris↗

DOE OSTI2021

Excitation dynamics in inductively coupled fluxonium circuits

We propose a near-term quantum simulator based on the fluxonium qubits inductively coupled to form a chain. This system provides long coherence time, large anharmonicity, and strong coupling, making it suitable to study Ising spin models. At the half-flux quantum sweet spot, the system is described by the transverse field Ising model (TFIM). We evaluate the propagation of qubit excitations through the system. As disorder increases, the excitations become localized. A single qubit measurement using the circuit QED methods is sufficient to identify localization transition without introducing tunable couplers. We argue that inductively coupled fluxoniums provide opportunities to study localization and many-body effects in highly coherent quantum systems.

Barış Özgüler, A.↗

DOE OSTI2025

Optically accessible high-finesse millimeter-wave resonator for cavity quantum electrodynamics with atom arrays

Cavity quantum electrodynamics (QED) is a powerful tool in quantum science, enabling preparation of nonclassical states of light and scalable entanglement of many atoms coupled to a single field mode. While the most coherent atom-photon interactions have been achieved using superconducting millimeter-wave cavities coupled to Rydberg atoms, these platforms so far lack the optical access required for trapping and addressing individual atomic qubits. We present a millimeter-wave Fabry-Pérot cavity with finesse 5.8⁢(1) ×10 7 at a temperature of 1 K providing generous transverse optical access (numerical aperture 0.56). Conflicting goals of strong atom-photon coupling and optical access motivate a near-confocal geometry. Close to confocality, however, postparaxial corrections to the cavity spectrum introduce unexpected degeneracies between transverse modes, leading to excess cavity loss. Modeling these corrections allows for tuning the cavity geometry to evade this loss, producing a high finesse that will enable cavity QED experiments with trapped atoms deep in the strong coupling regime.

Zhang, Tony [Stanford Univ., CA (United States); S↗

DOE OSTI2024

Site Suitability and Air Pollution Impacts of Composting Infrastructure for California’s Organic Waste Diversion Law

The emerging field of polaritonic chemistry explores the behavior of molecules under strong coupling with cavity modes. Despite recent developments in ab initio polaritonic methods for simulating polaritonic chemistry under electronic strong coupling, their capabilities are limited, especially in cases where the molecule also features strong electronic correlation. To bridge this gap, we have developed a novel method for cavity QED calculations utilizing the Density Matrix Renormalization Group (DMRG) algorithm in conjunction with the Pauli–Fierz Hamiltonian. Our approach is applied to investigate the effect of the cavity on the S0–S1 transition of n-oligoacenes, with n ranging from 2 to 5, encompassing 22 fully correlated π orbitals in the largest pentacene molecule. Our findings indicate that the influence of the cavity intensifies with larger acenes. Additionally, we demonstrate that, unlike the full determinantal representation, DMRG efficiently optimizes and eliminates excess photonic degrees of freedom, resulting in an asymptotically constant computational cost as the photonic basis increases.

54 ENVIRONMENTAL SCIENCES↗

DOE OSTI2024

Cavity-modified molecular dipole switching dynamics

Polaritonic states, which are formed by resonances between a molecular excitation and the photonic mode of a cavity, have a number of useful properties that offer new routes to control molecular photochemistry using electric fields. To provide a theoretical description of how polaritonic states affect the real-time electron dynamics in molecules, a new method is described where the effects of strong light–molecule coupling are implemented using real-time electronic structure theory. The coupling between the molecular electronic states and the cavity is described by the Pauli–Fierz Hamiltonian, and transitions between polaritonic states are induced via an external time-dependent electric field using time-dependent configuration interaction (TDCI) theory, producing quantum electrodynamics TDCI (QED-TDCI). This method is used to study laser-induced ultrafast charge transfer and dipole-switching dynamics of the LiCN molecule inside a cavity. The increase in cavity coupling strength is found to have a significant impact on the energies and transition dipole moments of the molecule–cavity system. The convergence of the polaritonic state energies as a function of the number of included electronic and photonic basis states is discussed.

Chemistry↗

DOE OSTI2022

Bootstrapping conformal QED 3 and deconfined quantum critical point

We bootstrap the deconfined quantum critical point (DQCP) and 3D Quantum Electrodynamics (QED 3 ) coupled to N f flavors of two-component Dirac fermions. We show the lattice and perturbative results on the SO(5) symmetric DQCP are excluded by the bootstrap bounds with an assumption that the lowest singlet scalar is irrelevant. Remarkably, we discover a new family of kinks in the 3D SO(N) vector bootstrap bounds with N &GreaterSlantEqual; 6. We demonstrate coincidences between SU(N f ) adjoint and $SO (N^2_f-1$) vector bootstrap bounds due to a novel algebraic relation between the crossing equations. By introducing gap assumptions breaking the $SO (N^2_f-1$) symmetry, the SU(N f ) adjoint bootstrap bounds with large N f converge to the 1/N f perturbative results of QED 3 . Our results provide strong evidence that the SO(5) DQCP is not continuous and the critical flavor number of QED 3 is slightly above 2: $N^*_f\in$ (2,4). Bootstrap results near $N^*_f$ are well consistent with the merger and annihilation mechanism for the loss of conformality in QED 3 .

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

DOE OSTI2022

Simulating Effective QED on Quantum Computers

In recent years simulations of chemistry and condensed materials has emerged as one of the preeminent applications of quantum computing, offering an exponential speedup for the solution of the electronic structure for certain strongly correlated electronic systems. To date, most treatments have ignored the question of whether relativistic effects, which are described most generally by quantum electrodynamics (QED), can also be simulated on a quantum computer in polynomial time. Here we show that effective QED, which is equivalent to QED to second order in perturbation theory, can be simulated in polynomial time under reasonable assumptions while properly treating all four components of the wavefunction of the fermionic field. In particular, we provide a detailed analysis of such simulations in position and momentum basis using Trotter-Suzuki formulas. We find that the number of T -gates needed to perform such simulations on a 3 D lattice of n s sites scales at worst as O ( n s 3 / ϵ ) 1 + o ( 1 ) in the thermodynamic limit for position basis simulations and O ( n s 4 + 2 / 3 / ϵ ) 1 + o ( 1 ) in momentum basis. We also find that qubitization scales slightly better with a worst case scaling of O ~ ( n s 2 + 2 / 3 / ϵ ) for lattice eQED and complications in the prepare circuit leads to a slightly worse scaling in momentum basis of O ~ ( n s 5 + 2 / 3 / ϵ ) . We further provide concrete gate counts for simulating a relativistic version of the uniform electron gas that show challenging problems can be simulated using fewer than 10 13 non-Clifford operations and also provide a detailed discussion of how to prepare multi-reference configuration interaction states in effective QED which can provide a reasonable initial guess for the ground state. Finally, we estimate the planewave cutoffs needed to accurately simulate heavy elements such as gold.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

DOE OSTI2023

Proton Electric Charge Radius from Lepton Scattering

A proton is a bound state of a strong interaction, governed by Quantum Chromodynamics (QCD). The electric charge radius of a proton, denoted by $r^{p}_{E}$, characterizes the spatial distribution of its electric charge carried by the quarks. It is an important input for bound-state Quantum Electrodynamic (QED) calculations of the hydrogen atomic energy levels. However, physicists have been puzzled by the large discrepancy between $r^{p}_{E}$ measurements from muonic hydrogen spectroscopy and those from ep elastic scattering and ordinary hydrogen spectroscopy for over a decade. Tremendous efforts, both theoretical and experimental, have been dedicated to providing various insights into this puzzle, but certain issues still remain unresolved, particularly in the field of lepton scatterings. This review will focus on lepton-scattering measurements of $r^{p}_{E}$, recent theoretical and experimental developments in this field, as well as future experiments using this technique.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

DOE OSTI2023

Exclusive dielectron production in ultraperipheral Pb+Pb collisions at $\sqrt{s_{\textrm{NN}}}$ = 5.02 TeV with ATLAS

Exclusive production of dielectron pairs, γγ → e + e – , is studied using $\mathcal{L}_{int}$ = 1.72 nb –1 of data from ultraperipheral collisions of lead nuclei at $\sqrt{s_{NN}}$ = 5.02 TeV recorded by the ATLAS detector at the LHC. The process of interest proceeds via photon–photon interactions in the strong electromagnetic fields of relativistic lead nuclei. Dielectron production is measured in the fiducial region defined by following requirements: electron transverse momentum $p^{e}_{T}$ > 2.5 GeV, absolute electron pseudorapidity |η e | < 2.5, dielectron invariant mass m ee > 5 GeV, and dielectron transverse momentum $p^{ee}_{T}$ < 2 GeV. Differential cross-sections are measured as a function of m ee , average $p^{e}_{T}$, absolute dielectron rapidity |y ee |, and scattering angle in the dielectron rest frame, |cos θ*|, in the inclusive sample, and also with a requirement of no activity in the forward direction. The total integrated fiducial cross-section is measured to be 215 ± 1 (stat) $^{+23}_{-20}$ (syst.) ± 4 (lumi.) μ b. Within experimental uncertainties the measured integrated cross-section is in good agreement with the QED predictions from the Monte Carlo programs STARLIGHT and SUPERCHIC, confirming the broad features of the initial photon fluxes. The differential cross-sections show systematic differences from these predictions which are more pronounced at high |y ee | and |cos θ*| values.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

DOE OSTI2024

Dark fluxes from electromagnetic cascades

We study dark sector production in electromagnetic (EM) cascades. This problem requires accurate simulations of Standard Model (SM) and dark sector processes, both of which impact angular and energy distributions of emitted particles that ultimately determine flux predictions in a downstream detector. We describe the minimal set of QED processes which must be included to faithfully reproduce a SM cascade, and identify a universal algorithm to generate a dark sector flux given a Monte-Carlo simulation of a SM shower. We provide a new tool, "Image missing", which simulates EM cascades with associated dark vector production, and compare it against existing literature and “off the shelf” tools. The signal predictions at downstream detectors can strongly depend on the nontrivial interplay (and modelling) of SM and dark sector processes, in particular multiple Coulomb scattering and positron annihilation. We comment on potential impacts of these effects for realistic experimental setups.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

DOE OSTI2024

A heavy QCD axion and the mirror world

We study the mirror world with dark matter arising from the thermal freeze-out of the lightest, stable mirror particle — the mirror electron. The dark matter abundance is achieved for mirror electrons of mass 225 GeV, fixing the mirror electroweak scale near 10 8 GeV. This highly predictive scenario is realized by an axion that acts as a portal between the two sectors through its coupling to the QCD and mirror QCD sectors. The axion is more massive than the standard QCD axion due to additional contributions from mirror strong dynamics. Still, the strong CP problem is solved by this ‘heavy’ axion due to the alignment of the QCD and mirror QCD potentials. Mirror entropy is transferred into the Standard Model sector via the axion portal, which alleviates overproduction of dark radiation from mirror glueball decays. This mirror scenario has a variety of signals: (1) primordial gravitational waves from the first-order mirror QCD phase transition occurring at a temperature near 35 GeV, (2) effects on large-scale structure from dark matter self-interactions from mirror QED, (3) dark radiation affecting the cosmic microwave background, and (4) the rare kaon decay, K + → (π + + axion). The first two signals do not depend on any fundamental free parameters of the theory while the latter two depend on a single free parameter, the axion decay constant.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

NASA NTRS2017

Precise Determination of the 1s Lamb Shift in Hydrogen-Like Lead and Gold Using Microcalorimeters

Quantum electrodynamics in very strong Coulomb fields is one scope which has not yet been tested experimentally with sufficient accuracy to really determine whether the perturbative approach is valid. One sensitive test is the determination of the 1s Lamb shift in highly-charged very heavy ions. The 1s Lamb shift of hydrogen-like lead (Pb81+) and gold (Au78+) has been determined using the novel detector concept of silicon microcalorimeters for the detection of hard x-rays. The results of (260 +/- 53) eV for lead and (211 +/- 42) eV for gold are within the error bars in good agreement with theoretical predictions. To our knowledge, for hydrogen-like lead, this represents the most accurate determination of the 1s Lamb shift.

microcalorimeters for↗