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DOE OSTI2013

Self-generated magnetic fields in q-distributed plasmas

A quasi-steady magnetic field can be generated with high-frequency electromagnetic radiation through wave-wave and wave-particle interactions in astrophysical plasmas and laser-produced plasmas. Nonlinear coupling equations of self-generated magnetic fields are obtained in nonextensive distribution frame, as a generalization for the standard Maxwellian distribution frame. The numerical results show that self-generated magnetic fields may collapse and lead to various turbulent patterns with different index q.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

DOE OSTI2021

Mapping the electromagnetic fields of heavy-ion collisions with the Breit-Wheeler process

Ultra-relativistic heavy-ion collisions are expected to produce the strongest electromagnetic fields in the known Universe. These highly-Lorentz contracted fields can manifest themselves as linearly polarized quasi-real photons that can interact via the Breit-Wheeler process to produce lepton anti-lepton pairs. Furthermore, the energy and momentum distribution of the produced dileptons carry information about the strength and spatial distribution of the colliding fields. Recently it has been demonstrated that photons from these fields can interact even in heavy-ion collisions with hadronic overlap, providing a purely electromagnetic probe of the produced medium. In this review we discuss the recent theoretical progress and experimental advances for mapping the ultra-strong electromagnetic fields produced in heavy-ion collisions via measurement of the Breit-Wheeler process.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

DOE OSTI2012

Simulation of relativistically colliding laser-generated electron flows

The plasma dynamics resulting from the simultaneous impact, of two equal, ultra-intense laser pulses, in two spatially separated spots, onto a dense target is studied via particle-in-cell simulations. The simulations show that electrons accelerated to relativistic speeds cross the target and exit at its rear surface. Most energetic electrons are bound to the rear surface by the ambipolar electric field and expand along it. Their current is closed by a return current in the target, and this current configuration generates strong surface magnetic fields. The two electron sheaths collide at the midplane between the laser impact points. The magnetic repulsion between the counter-streaming electron beams separates them along the surface normal direction, before they can thermalize through other beam instabilities. This magnetic repulsion is also the driving mechanism for the beam-Weibel (filamentation) instability, which is thought to be responsible for magnetic field growth close to the internal shocks of gamma-ray burst jets. The relative strength of this repulsion compared to the competing electrostatic interactions, which is evidenced by the simulations, suggests that the filamentation instability can be examined in an experimental setting.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

DOE OSTI2011

Polarized top pair production in extra dimension models via photon-photon fusion at the CERN LHC

We study the potential of processes pp{yields}p{gamma}{gamma}p{yields}pttp in scenarios of the Arkani-Hamed-Dimopoulos-Dvali and the Randall-Sundrum model at the LHC. We obtain 95% C.L. bounds on the model parameters. We show top quark spin asymmetry can be detected and discerned from the standard model with these extra dimensional models.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

DOE OSTI2014

Transport signatures of Majorana quantum criticality realized by dissipative resonant tunneling

We consider theoretically the transport properties of a spinless resonant electronic level coupled to strongly dissipative leads, in the regime of circuit impedance near the resistance quantum. Using the Luttinger liquid analogy, one obtains an effective Hamiltonian expressed in terms of interacting Majorana fermions, in which all environmental degrees of freedom (leads and electromagnetic modes) are encapsulated in a single fermionic bath. General transport equations for this system are then derived in terms of the Majorana T-matrix. Perturbative treatment of the Majorana interaction term yields the appearance of a marginal, linear dependence of the conductance on temperature when the system is tuned to its quantum critical point, in agreement with recent experimental observations. Here, we investigate in detail the different crossovers involved in the problem, and analyze the role of the interaction terms in the transport scaling functions. In particular, we show that single barrier scaling applies when the system is slightly tuned away from its Majorana critical point, strengthening the general picture of dynamical Coulomb blockade.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

DOE OSTI2014

Current density partitioning in time-dependent current density functional theory

We adapt time-dependent current density functional theory to allow for a fragment-based solution of the many-electron problem of molecules in the presence of time-dependent electric and magnetic fields. Regarding a molecule as a set of non-interacting subsystems that individually evolve under the influence of an auxiliary external electromagnetic vector-scalar potential pair, the partition 4-potential, we show that there are one-to-one mappings between this auxiliary potential, a sharply-defined set of fragment current densities, and the total current density of the system. The partition electromagnetic (EM) 4-potential is expressed in terms of the real EM 4-potential of the system and a gluing EM 4-potential that accounts for exchange-correlation effects and mutual interaction forces between fragments that are required to yield the correct electron dynamics. We prove the zero-force theorem for the fragmented system, establish a variational formulation in terms of action functionals, and provide a simple illustration for a charged particle in a ring.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2018

Computing the dipole polarizability of Ca 48 with increased precision

Here, we compute the electric dipole polarizability of 48 Ca with an increased precision by including more correlations than in previous studies. Employing the coupled-cluster method we go beyond single and double excitations and include leading-order three-particle-three-hole (3p-3h) excitations for the ground state, excited states, and the similarity-transformed operator. We study electromagnetic sum rules, such as the bremsstrahlung sum rule m 0 and the polarizability sum rule αD using interactions from chiral effective field theory. To gauge the quality of our coupled-cluster approximations we perform several benchmarks with the effective interaction hyperspherical harmonics approach in 4 He and with self consistent Green's function in 16 O. We compute the dipole polarizability of 48 Ca employing the chiral interaction N 2 LO sat and the 1.8/2.0 (EM). We find that the effect of 3p-3h excitations in the ground state is small for 1.8/2.0 (EM) but non-negligible for N 2 LO sat . The addition of these new correlations allows us to improve the precision of our 48 Ca calculations and reconcile the recently reported discrepancy between coupled-cluster results based on these interactions and the experimentally determined αD from proton inelastic scattering in 48 Ca. For the computation of electromagnetic and polarizability sum rules, the inclusion of leading-order 3p-3h excitations in the ground state is important, while it is less so for the excited states and the similarity-transformed dipole operator.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

DOE OSTI2025

Electromagnetic shower reconstruction in the ICARUS liquid argon time projection chamber detector

The ICARUS-T600 liquid argon time projection chamber (LArTPC) detector is taking data at shallow depth as the far detector of the Short Baseline Neutrino (SBN) program at Fermilab, to search for a possible sterile neutrino signal at $\Delta m^{2} \approx 1~\text{eV}^{2}$ with the Booster (BNB) and Main Injector (NuMI) neutrino beams at $\GeV{\sim 0.8}$ and $\GeV{\sim 2}$ average energies respectively. The LArTPC technology, developed by the ICARUS collaboration and now a standard in neutrino physics, offers impressive charged-particle imaging capabilities with $\sim1 \ \text{mm}$ spatial resolution, enabling efficient discrimination between track-like signatures (e.g., from muons, pions, and protons) and electromagnetic showers (from electrons and photons). Moreover, electron and photon signatures can be distinguished both with the calorimetric measurement of local energy depositions at the shower start and with the cm-scale conversion gap signature of photons. This contribution discusses event reconstruction at ICARUS focusing on Pandora, a multi-algorithm pattern recognition software widely used in LArTPC experiments. Over a hundred Pandora algorithms and tools are used to reconstruct cosmic rays and neutrino interactions in the ICARUS detector. Recent developments have focused on the reconstruction of electromagnetic shower signatures, crucial to ensure a robust and efficient reconstruction of charged-current $\nu_e$ interactions, which serve as a key signature of sterile neutrino oscillations at SBN. In this contribution, recent improvements to the reconstruction are discussed, focusing on the discrimination between tracks and electromagnetic showers using neutrino simulations and data.

Triozzi, Riccardo [Padua U.; INFN, Padua] (ORCID:0↗

DOE OSTI2019

Experimental Study of the Mold Flow Induced by a Swirling Flow Nozzle and Electromagnetic Stirring for Continuous Casting of Round Blooms

This study focuses on an experimental investigation of the fluid flow in round bloom continuous casting using a 1:3 model of the industrial casting process. A swirling flow nozzle, represented by the specific design of the RHI Magnesita GYRONOZZLE, is used to produce a swirling motion in the cylindrical mold. The test section is integrated into the Mini-LIMMCAST facility at HZDR, which is operated at room temperature using the ternary alloy GaInSn. Systematic measurements of horizontal and vertical velocity profiles are performed by means of the Ultrasound Doppler Velocimetry. The second part of the study focuses on the interaction between the flow driven by the GYRONOZZLE and concurrent electromagnetic stirring in the mold (M-EMS) by applying rotating magnetic fields (RMFs) at different magnetic flux densities. The effect of the GYRONOZZLE on the flow pattern inside the mold is examined with and without superimposed RMFs and compared to those of a standard single-port nozzle. The measurements reveal that the GYRONOZZLE induces a swirling flow in the whole mold. It is further shown that the influence of a simultaneously applied RMF is mainly restricted to the lower part of the mold since the transport of angular momentum to the top is suppressed by the jets pouring out from the GYRONOZZLE.

36 MATERIALS SCIENCE↗

DOE OSTI2011

Kaonic Atoms

The precision spectroscopy of kaonic hydrogen and kaonic helium x-rays offers a unique possibility to precisely determine the K{sup -}N strong interaction in the low energy limit. Results and status of modern experiments using silicon drift x-ray detectors (SDDs), namely, KEK E570, SIDDHARTA at DA{Phi}NE and E17 at J-PARC, are discussed.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

DOE OSTI2024

NeuroSEM: A hybrid framework for simulating multiphysics problems by coupling PINNs and spectral elements

Multiphysics problems that are characterized by complex interactions among fluid dynamics, heat transfer, structural mechanics, and electromagnetics, are inherently challenging due to their coupled nature. While experimental data on certain state variables may be available, integrating these data with numerical solvers remains a significant challenge. Physics-informed neural networks (PINNs) have shown promising results in various engineering disciplines, particularly in handling noisy data and solving inverse problems in partial differential equations (PDEs). However, their effectiveness in forecasting nonlinear phenomena in multiphysics regimes, particularly involving turbulence, is yet to be fully established. Here, this study introduces NeuroSEM, a hybrid framework integrating PINNs with the highfidelity Spectral Element Method (SEM) solver, Nektar++. NeuroSEM leverages the strengths of both PINNs and SEM, providing robust solutions for multiphysics problems. PINNs are trained to assimilate data and model physical phenomena in specific subdomains, which are then integrated into the Nektar++ solver. We demonstrate the efficiency and accuracy of NeuroSEM for thermal convection in cavity flow and flow past a cylinder. The framework effectively handles data assimilation by addressing those subdomains and state variables where the data is available. We applied NeuroSEM to the Rayleigh-B´enard convection system, including cases with missing thermal boundary conditions and noisy datasets. Finally, we applied the proposed NeuroSEM framework to real particle image velocimetry (PIV) data to capture flow patterns characterized by horseshoe vortical structures. Our results indicate that NeuroSEM accurately models the physical phenomena and assimilates the data within the specified subdomains. The framework’s plug-and-play nature facilitates its extension to other multiphysics or multiscale problems. Furthermore, NeuroSEM is optimized for efficient execution on emerging integrated GPU-CPU architectures. This hybrid approach enhances the accuracy and efficiency of simulations, making it a powerful tool for tackling complex engineering challenges in various scientific domains.

42 ENGINEERING↗

DOE OSTI2023

Code-verification techniques for the method-of-moments implementation of the combined-field integral equation

Code verification plays an important role in establishing the credibility of computational simulations by assessing the correctness of the implementation of the underlying numerical methods. In computational electromagnetics, the numerical solution to integral equations incurs multiple interacting sources of numerical error, as well as other challenges, which render traditional code-verification approaches ineffective. In this paper, we provide approaches to separately measure the numerical errors arising from these different error sources for the method-of-moments implementation of the combined-field integral equation. Here, we demonstrate the effectiveness of these approaches for cases with and without coding errors.

97 MATHEMATICS AND COMPUTING↗

DOE OSTI2015

Enhanced Raman Scattering on In-plane Anisotropic Layered Materials

Surface-enhanced Raman scattering (SERS) on two-dimensional (2D) layered materials has provided a unique platform to study the chemical mechanism (CM) of the enhancement due to its natural separation from electromagnetic enhancement. The CM stems from the basic charge interactions between the substrate and molecules. Despite the extensive studies of the energy alignment between 2D materials and molecules, an understanding of how the electronic properties of the substrate are explicitly involved in the charge interaction is still unclear. Lately, a new group of 2D layered materials with anisotropic structure, including orthorhombic black phosphorus (BP) and triclinic rhenium disulphide (ReS2), has attracted great interest due to their unique anisotropic electrical and optical properties. Herein, we report a unique anisotropic Raman enhancement on few-layered BP and ReS2 using copper phthalocyanine (CuPc) molecules as a Raman probe, which is absent on isotropic graphene and h-BN. According to detailed Raman tensor analysis and density functional theory calculations, anisotropic charge interactions due to the anisotropic carrier mobilities of the 2D materials are responsible for the angular dependence of the Raman enhancement. Our findings not only provide new insights into the CM process in SERS, but also open up new avenues for the exploration and application of the electronic properties of anisotropic 2D layered materials.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

DOE OSTI2016

Nanoscale mapping of plasmon and exciton in ZnO tetrapods coupled with Au nanoparticles

Metallic nanoparticles can be used to enhance optical absorption or emission in semiconductors, thanks to a strong interaction of collective excitations of free charges (plasmons) with electromagnetic fields. Herein we present direct imaging at the nanoscale of plasmon-exciton coupling in Au/ZnO nanostructures by combining scanning transmission electron energy loss and cathodoluminescence spectroscopy and mapping. The Au nanoparticles (~30 nm in diameter) are grown in-situ on ZnO nanotetrapods by means of a photochemical process without the need of binding agents or capping molecules, resulting in clean interfaces. Interestingly, the Au plasmon resonance is localized at the Au/vacuum interface, rather than presenting an isotropic distribution around the nanoparticle. Moreover, on the contrary, a localization of the ZnO signal has been observed inside the Au nanoparticle, as also confirmed by numerical simulations.

77 NANOSCIENCE AND NANOTECHNOLOGY↗

DOE OSTI2015

Relativistic Eulerian Vlasov simulations of the amplification of seed pulses by Brillouin backscattering in plasmas

We apply an Eulerian Vlasov code to study the amplification by Brillouin scattering of a short seed laser pulse by a long pump laser pulse in an underdense plasma. The stimulated Brillouin backscattering interaction is the coupling of the pump and seed electromagnetic waves propagating in opposite directions, and the ion plasma wave. The code solves the one-dimensional relativistic Vlasov-Maxwell set of equations. Large amplitude ion waves are generated. In the simulations we present, the density plateau of the plasma is n{sub e}=0.3 n{sub c} (n{sub c} is the critical density), which excludes spurious stimulated Raman scattering amplification (which can occur only if n{sub e}<n{sub c}/4). We also varied the duration and/or amplitude of the short input seed pulse to study how these influence its subsequent behaviour. An initially broad pulse grows more rapidly than an initially narrow pulse. Furthermore, for an initially broader seed pulse, towards the end of the simulation, it is seen to become narrower and to gradually detach from the trailing signal. On the contrary, initially very narrow seed pulses are seen to broaden. The absence of noise in the Vlasov simulations allows to simulate long plasma amplifier lengths, and to follow the evolution of the system with a fully kinetic description and with an accurate representation of the phase-space structures of distribution function.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

DOE OSTI2023

Investigation of the significance of excited species in wave-heated dense non-ideal microplasmas using particle-in-cell Monte Carlo-collision modeling

A computational model for the interaction of a high-pressure microplasma with an electromagnetic wave is presented. A one-dimensional particle-in-cell Monte Carlo collision model is used to investigate the plasma non-ideality effects in a second-stage laser-heated xenon plasma with a comprehensive chemistry mechanism, including excited species. A xenon microplasma at a temperature of 300 K and pressure of 10 bar becomes non-ideal after the laser heating stage with lower ionization and electronic excitation barriers, which makes the presence of excited species important to the plasma generation process. For these conditions, two-step ionization via excited species becomes a major contributor to plasma ionization. We find that full ionization of the plasma is obtained in ~2 ps when excited species are included in the chemistry model, as opposed to ~2.5 ps for a chemistry mechanism that does not consider their effect. With excited species, the ionization mode transitions from direct ionization via electron-neutral collisions to direct and stepwise ionization as the plasma generation progresses.

36 MATERIALS SCIENCE↗

DOE OSTI2014

Origin of multi-band emission from the microquasar Cygnus X-1

We study the origin of non-thermal emissions from the Galactic black hole X-ray binary Cygnus X-1, which is a confirmed high-mass microquasar. By analogy with the methods used in studies of active galactic nuclei, we propose a two-dimensional, time-dependent radiation model from the microquasar Cygnus X-1. In this model, the evolution equation for relativistic electrons in a conical jet are numerically solved by including escape, adiabatic, and various radiative losses. The radiative processes involved are synchrotron emission, its self-Compton scattering, and inverse Compton scatterings of an accretion disk and its surrounding stellar companion. This model also includes an electromagnetic cascade process of an anisotropic γ-γ interaction. We study the spectral properties of electron evolution and its emission spectral characteristic at different heights of the emission region located in the jet. We find that radio data from Cygnus X-1 are reproduced by the synchrotron emission, the Fermi Large Area Telescope measurements by the synchrotron emission and Comptonization of photons of the stellar companion, and the TeV band emission fluxes by the Comptonization of the stellar photons. Our results show the following. (1) The radio emission region extends from the binary system scales to the termination of the jet. (2) The GeV band emissions should originate from the distance close to the binary system scales. (3) The TeV band emissions could be inside the binary system, and these emissions could be probed by the upcoming Cherenkov Telescope Array. (4) The MeV tail emissions, which produce a strongly linearly polarized signal, are emitted inside the binary system. The location of the emissions is very close to the inner region of the jet.

79 ASTRONOMY AND ASTROPHYSICS↗

DOE OSTI2023

Interplay between disorder, local relaxation, and collective behavior for an ensemble of emitters outside versus inside a cavity

The interplay between collective optical response and molecular static and dynamic disorder is studied using simple effective Hamiltonians for an ensemble of two-level emitters inside and outside a single-mode cavity. We model environmental disorder by randomly modulating the molecular transition frequencies and the coupling between the emitters and the electromagnetic field. We also consider the effects of intermolecular interactions and orientational disorder. We investigate how these effects lead to new features in the steady-state absorption (outside the cavity), transmission spectra (inside the cavity), and the yield of local molecular processes such as a unimolecular reaction. Outside the cavity, the collective behavior is manifested in the linewidth of the steady-state absorption, the emission spectrum, and the local chemical yield. Inside the cavity, however, the collective behavior primarily determines the Rabi splitting. The effects of intermolecular interactions under orientational disorder are also studied. For the most part, for all types of disorder, if we increase disorder, we find a reduction in the collective nature of the molecular response (smaller effective N) and therefore the Rabi splitting contraction occurs with orientational disorder. Furthermore, we find that static disorder is more destructive to collective behavior than dynamic disorder.

74 ATOMIC AND MOLECULAR PHYSICS↗