Engineering topics

Li, J.

Publications and source records attributed to Li, J..

At least 19 records

DOE OSTI2025

Decoherence of V B spin defects in monoisotopic hexagonal boron nitride

Spin defects in hexagonal boron nitride (hBN) are promising quantum systems for the design of flexible two-dimensional quantum sensing platforms. Here we rely on hBN crystals isotopically enriched with either 10B or 11B to investigate the isotope-dependent properties of a spin defect featuring a broadband photoluminescence signal in the near infrared. By analyzing the hyperfine structure of the spin defect while changing the boron isotope, we first unambiguously confirm that it corresponds to the negatively-charged boron-vacancy center (V− B ). We then show that its spin coherence properties are slightly improved in 10B-enriched samples. This is supported by numerical simulations employing cluster correlation expansion methods, which reveal the importance of the hyperfine Fermi contact term for calculating the coherence time of point defects in hBN. Using crossrelaxation spectroscopy, we finally identify dark electron spin impurities as an additional source of decoherence. This work provides new insights into the properties of V− B spin defects, which are valuable for the future development of hBN-based quantum sensing foils.

Haykal, A.↗

DOE OSTI2025

The Surface-Topography Challenge: A Multi-Laboratory Benchmark Study to Advance the Characterization of Topography

Surface performance is critically influenced by topography in virtually all real-world applications. The current standard practice is to describe topography using one of a few industry-standard parameters. The most commonly reported number is Ra, the average absolute deviation of the height from the mean line (at some, not necessarily known or specified, lateral length scale). However, other parameters, particularly those that are scale-dependent, influence surface and interfacial properties; for example the local surface slope is critical for visual appearance, friction, and wear. The present Surface-Topography Challenge was launched to raise awareness for the need of a multi-scale description, but also to assess the reliability of different metrology techniques. In the resulting international collaborative effort, 153 scientists and engineers from 64 research groups and companies across 20 countries characterized statistically equivalent samples from two different surfaces: a “rough” and a “smooth” surface. The results of the 2088 measurements constitute the most comprehensive surface description ever compiled. We find wide disagreement across measurements and techniques when the lateral scale of the measurement is ignored. Consensus is established through scale-dependent parameters while removing data that violates an established resolution criterion and deviates from the majority measurements at each length scale. Our findings suggest best practices for characterizing and specifying topography. The public release of the accumulated data and presented analyses enables global reuse for further scientific investigation and benchmarking.

42 ENGINEERING↗

DOE OSTI2024

Fundamental optical transitions in hexagonal boron nitride epilayers

Fundamental optical transitions in hexagonal boron nitride (h-BN) epilayers grown on sapphire by metal–organic chemical vapor deposition (MOCVD) using triethylboron as the boron precursor have been probed by photoluminescence (PL) emission spectroscopy. The low temperature (10 K) PL spectrum exhibits two groups of emission lines. The first group includes the direct observation of the free exciton and impurity bound exciton (BX) transitions and phonon replicas of the BX transition, whereas the second group is attributed to the direct observation of the band-to-band transition and its associated phonon replicas. The observations of zero-phonon lines of the band-to-band and exciton transitions, which are supposedly forbidden or “dark” in perfect h-BN crystals, result from a relaxed requirement of momentum conservation due to symmetry-breaking in the presence of high concentrations of impurities/defects and strain, which in turn provided more deterministic values of the energy bandgap (E g ), exciton binding energy (E x ), and binding energy of impurity bound excitons (E BX ) in h-BN epilayers. Excitonic parameters of h-BN epilayers grown by MOCVD, carbon-free chemical vapor deposition, and high purity h-BN bulk materials are compared and discussed. The present results, together with available information in the literature, represent a significant improvement in the understanding of the fundamental optical properties and excitonic parameters of h-BN ultrawide bandgap semiconductors.

36 MATERIALS SCIENCE↗

DOE OSTI2024

Capping Effects on Spin and Charge Excitations in Parent and Superconducting Nd 1-x Sr x⁢ NiO 2

Superconductivity in infinite layer nickelates Nd 1-x⁢ Sr x NiO 2 has so far been achieved only in thin films, raising questions on the role of substrates and interfaces. Given the challenges associated with their synthesis it is imperative to identify their intrinsic properties. We use resonant inelastic x-ray scattering to investigate the influence of the SrTiO 3 capping layer on the excitations of Nd 1-x ⁢Sr x⁢ NiO 2 (x =0 and 0.2). Spin excitations are observed in parent and 20% doped Nd 1-x Sr x ⁢NiO 2 regardless of capping, proving that magnetism is intrinsic to infinite-layer nickelates and appears in a significant fraction of their phase diagram. In parent and superconducting Nd 1-x Sr x ⁢NiO 2 , the spin excitations are slightly hardened in capped samples compared to the noncapped ones. Additionally, a weaker Ni-Nd charge transfer peak at ~0.6 eV suggests that the hybridization between Ni 3⁢d and Nd 5⁢d orbitals is reduced in capped samples. In conclusion, from our data, capping induces only minimal differences in Nd 1-x Sr x NiO 2 and we phenomenologically discuss these differences based on the reconstruction of the SrTiO 3 -NdNiO 2 interface and other mechanisms such as crystalline disorder.

36 MATERIALS SCIENCE↗

DOE OSTI2024

Evolution of shell gaps in the neutron-poor calcium region from invariant-mass spectroscopy of 37,38 Sc, 35 Ca, 34 K

A fast secondary beam of 37 Ca impinged on a 9 Be target resulting in a set of reactions populating proton-rich nuclei including 35 Ca and the first observations of 37,38 Sc and 34 K. Invariant-mass spectroscopy, used to reconstruct proton decays for these nuclei, yielded three new ground-state masses and information on their low-lying structures. The newly measured mass excesses are: ΔM( 37 Sc) = 3500(410) keV, ΔM( 38 Sc) = –4656(14) keV, and ΔM( 34 K) = –1487(17) keV. These nuclei straddle the well-known Z = 20 shell closure as well as the N = 16 subshell closure. Furthermore, trends in separation energies help elucidate how nuclear structure evolves showing a fading of the Z = 20 shell gap for N ≥ 18 and indications of a N = 16 subshell gap.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

DOE OSTI2024

Probing room temperature indirect and minimum direct band gaps of h-BN

Abstract Hexagonal boron nitride (h-BN) has attracted considerable interest as an ultrawide bandgap (UWBG) semiconductor. Experimental studies focused on the detailed near band-edge structure of h-BN at room temperature are still lacking. We report a direct experimental measurement of the near band-edge structure performed on h-BN quasi-bulk wafers via photocurrent excitation spectroscopy (PES). PES resolved the band-to-band transitions near M- and K-points in the Brillion zone (BZ), from which the room temperature indirect band gap of E g M K ∼6.02 eV, minimum direct bandgap at M-point of E g M = 6.36 eV and next lowest direct energy bandgap at K-point of E g K = 6.56 eV , have been simultaneously determined for the first time experimentally. The measured energy differences between K- and M-points in the conduction band minimum (CBM) and valence band maximum (VBM) are Δ E C M K = 0.54 eV and Δ E V M K = 0.34 eV, respectively, in good agreement with the calculation results. Significantly differing from its III-nitride wurtzite counterparts, in which only electrons and holes in the conduction and valence band extremes at the Γ-point are predominantly involved in the optical and transport processes, the results highlighted that charge carriers associated with both M- and K-valleys control to the optical excitation, recombination and charge transport processes in h-BN.

Physics↗

DOE OSTI2024

Proton and neutron contributions to the quadrupole transition strengths in 39 Ca and 39 K studied by lifetime measurements of mirror transitions

The E2 transition matrix elements of isobaric multiplets are expected to follow a linear trend as a function of isospin projection. However, measurements of the 2 + → 0 + transitions in the A = 38 triplet of Ca, K, and Ar show a deviation from this trend with an enhanced transition strength in 38 Ca with respect to its mirror 38 Ar. We have studied analogue 11/2 – → 7/2 – E2 transitions in 39 Ca and its mirror partner 39 K to determine if this enhancement persists in neighboring Ca isotopes. Recoil-distance lifetime measurements of 39 Ca and 39 K were performed utilizing a 42 Sc secondary beam, the TRIPLEX plunger, the GRETINA array, and the S800 spectrograph. Our data provide a lifetime measurement of the (11/2 – ) state in 39 Ca as well as an improved lifetime result for the (9/2 – ) state, while the 39 K data are used to validate the present analysis. Furthermore, a comparison of the present data to shell-model calculations suggests an enhanced transition strength in 39 Ca, pointing to both proton and neutron contributions to core excitations across the Z = N = 20 shell gaps in close proximity to 40 Ca.

39 ≤ A ≤ 58↗

DOE OSTI2024

Nonlinear modeling of ELM mitigation with RMP on HL-2A

Abstract Nonlinear modeling of mitigation of the edge localized mode (ELM) with resonant magnetic perturbation (RMP) is performed for the HL-2A tokamak, utilizing the three-dimensional (3D) magnetohydrodynamic code JOREK. Based on the 3D equilibrium established after application of the n = 1 ( n is the toroidal mode number) RMP at 4.9 kAt coil current with odd parity, ELM mitigation is successfully simulated consistent with the experimental result. Nonlinear simulations show strong mode coupling among toroidal Fourier harmonics, allowing redistribution of the magnetic energy such that the most unstable toroidal mode saturates at a lower level. This magnetic energy cascade offers an explanation of the RMP-induced ELM mitigation achieved in HL-2A. Detailed examination of the simulation results shows persistent resonant field screening even during the ELM mitigation phase. Finite plasma resistivity however does enable partial penetration of the resonant field thus modifying the edge magnetic topology and characteristics of the edge transport. Plasma radial profiles undergo pronounced changes around the pedestal region, when the magnetic energy of the most unstable toroidal mode reaches the maximum value. Systematic scans of the applied RMP coil current with the JOREK simulations find a threshold value of around 4.5 kAt required for achieving the ELM mitigation on HL-2A.

Physics↗

DOE OSTI2024

In-beam γ -ray spectroscopy of negative-parity states of 37 K populated in dissipative reactions

In-beam γ-ray spectroscopy was used to study excited states of the neutron-deficient nucleus 37 K populated in fast-beam inelastic-scattering and proton-removal reactions at high-momentum loss. New γ-ray transitions and γγ coincidence relationships were established using the γ-ray tracking array GRETINA. The extension of the level scheme up to the first (13/2 – ) state highlights the potential of this recently demonstrated population pathway for studies of isospin symmetry involving mirror-energy differences. Furthermore, the nature of the newly identified states is discussed in comparison to shell-model calculations with the FSU cross-shell effective interaction. The calculated occupation numbers of individual orbitals are shown to offer a consistent explanation of the measured mirror-energy differences between 37 K and 37 Ar.

20 ≤ A ≤ 38↗

DOE OSTI2024

TRANSFER LEARNING FOR FIELD EMISSION MITIGATION IN CEBAF SRF CAVITIES

The Continuous Electron Beam Accelerator Facility (CEBAF) at Jefferson Lab operates hundreds of super-conducting radio frequency (SRF) cavities in its two linear accelerators (linacs). Field emission (FE) is an ongoing operational challenge in higher gradient SRF cavities. FE generates high levels of neutron and gamma radiation leading to damaged accelerator hardware and a radiation hazard environment. During machine development periods, we performed gradient scans to record data capturing the relationship between cavity gradients and radiation levels measured throughout the linacs. However, the field emission environment at CEBAF varies considerably over time as the configuration of the radio frequency (RF) gradients changes and due to the changing behaviour of field emitters. An artificial intelligence/machine learning (AI/ML) approach with transfer learning could be a valuable tool to mitigate FE and lower the radiation levels. In this work, we mainly focus on leveraging the RF trip data gathered during CEBAF operations. We develop a transfer learning-based surrogate model for radiation detector readings given RF cavity gradients to track the CEBAF?s changing configuration and environment. Then, we could use the developed model as an optimization process for redistributing the RF gradients within a linac to minimize radiation levels.

Ahammed, K.↗

DOE OSTI2024

TRANSFER LEARNING FOR FIELD EMISSION MITIGATION IN CEBAF SRF CAVITIES

Ahammed, K.↗

DOE OSTI2024

Magnetically propagating Hund’s exciton in van der Waals antiferromagnet NiPS3

Abstract Magnetic van der Waals (vdW) materials have opened new frontiers for realizing novel many-body phenomena. Recently NiPS 3 has received intense interest since it hosts an excitonic quasiparticle whose properties appear to be intimately linked to the magnetic state of the lattice. Despite extensive studies, the electronic character, mobility, and magnetic interactions of the exciton remain unresolved. Here we address these issues by measuring NiPS 3 with ultra-high energy resolution resonant inelastic x-ray scattering (RIXS). We find that Hund’s exchange interactions are primarily responsible for the energy of formation of the exciton. Measuring the dispersion of the Hund’s exciton reveals that it propagates in a way that is analogous to a double-magnon. We trace this unique behavior to fundamental similarities between the NiPS 3 exciton hopping and spin exchange processes, underlining the unique magnetic characteristics of this novel quasiparticle.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

DOE OSTI2024

Investigation of the $\gamma $-ray Properties of the $2^+$ States in $^{14}$C

The properties of the 2$^+_1$ and 2$^+_2$ excited states in 14 C were studied in an experiment conducted at Argonne National Laboratory. A 9 Be( 6 Li,pγ) fusion-evaporation reaction and the GRETINA-ORRUBA setup were employed to populate states of 14 C and detect γ-particle coincidence events. Finally, the precise determination of the 2$^+_1$ level energy, complemented by the estimation of the γ-ray branch of the 2$^+_2$ near-threshold state, will serve as a benchmark to test the Shell Model Embedded in the Continuum calculations.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

DOE OSTI2024

Graph Analytics for CEBAF Operations

We report on the progress achieved during a 2-year Laboratory Directed Research and Development (LDRD) project titled “Graph Analytics for CEBAF Operations”. The objective of this project is to leverage deep learning on graph representations of CEBAF’s injector beamline in order to create a tool for improving the efficiency of beam tuning tasks. Specifically, we use graphs to represent the injector beamline at any arbitrary date and time and invoke a graph neural network (GNN) to extract a low-dimensional, informative representation that can be visualized in two-dimensions. By analyzing years of operational data from the CEBAF archiver, good and bad regions of parameter space can be identified. The goal is to exercise this framework as a real-time tool to aid beam tuning, which represents the dominant source of machine downtime.

43 PARTICLE ACCELERATORS↗

DOE OSTI2024

Emergence of composite many-body exciton states in WS 2 and MoSe 2 monolayers

When doped with a high density of mobile charge carriers, monolayer transition-metal dichalcogenide (TMD) semiconductors can host new types of composite many-particle exciton states that do not exist in conventional semiconductors. Further, such multiparticle bound states arise when a photoexcited electron-hole pair couples not to just a single Fermi sea that is quantum-mechanically distinguishable (as in the case of conventional charged excitons or trions), but rather couples simultaneously to multiple Fermi seas, each having distinct spin and valley quantum numbers. Composite six-particle “hexciton” states were recently identified in electron-doped $WSe$ $2$ monolayers, but under suitable conditions they should also form in all other members of the monolayer TMD family. Here we present spectroscopic evidence demonstrating the emergence of many-body hexcitons in charge-tunable $WS$ $2$ monolayers (at the A-exciton) and $MoSe$ $2$ monolayers (at the B-exciton). The roles of distinguishability and carrier screening on the stability of hexcitons are discussed.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗

DOE OSTI2024

Proton removal from Br 73 , 75 to Se 72 , 74 at intermediate energies

Herein we report new experimental data for excited states of 72,74 Se obtained from proton removal from 73,75 Br secondary beams on a proton target. The experiments were performed with the Ursinus-NSCL Liquid Hydrogen Target and the combined GRETINA+S800 setup at the Coupled Cyclotron Facility of the National Superconducting Cyclotron Laboratory at Michigan State University. Within uncertainties, the inclusive cross sections for proton removal from 73,75 Br on a proton target are identical suggesting that the same single-particle orbitals contribute to the proton-removal reaction. In addition, details of the partial cross section fragmentation are discussed. The data might suggest that l = 1, 2, 3, and 4 angular momentum transfers are important to understand the population of excited states of 72,74 Se in proton removal. Available data for excited states of 74 Ge populated through the 75 As(d, 3 He) 74 Ge proton-removal reaction in normal kinematics suggest indeed that the fp and sd shell as well as the 1g 9/2 orbital contribute. A comparison to data available for odd-A nuclei supports that the bulk of the spectroscopic strengths could be found at lower energies in the even-even Se isotopes than in, for instance, the even-even Ge isotopes. In addition, the population of high-J states seems to indicate that multi-step processes contribute to proton-removal reactions at intermediate energies in these collective nuclei.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗

DOE OSTI2023

Probing proton cross-shell excitations through the two-neutron removal from 38 Ca

Bound states of the neutron-deficient, near-dripline nucleus 36 Ca were populated in two-neutron removal from the ground state of 38 Ca, a direct reaction sensitive to the single-particle configurations and couplings of the removed neutrons in the projectile wave function. Final-state exclusive cross sections for the formation of 36 Ca and the corresponding longitudinal momentum distributions, both determined through the combination of particle and γ-ray spectroscopy, are compared to predictions combining eikonal reaction theory and shell-model two-nucleon amplitudes from the USDB, USDC, and ZBM2 effective interactions. The final-state cross-section ratio σ($2$$^{+}_{1}$) / σ (0 + ) shows particular sensitivity and is approximately reproduced only with the two-nucleon amplitudes from the ZBM2 effective interaction that includes proton cross-shell excitations into the pf shell. Characterizing the proton pf-shell occupancy locally and schematically, an increase of the sd – pf shell gap by 250 keV yields an improved description of this cross-section ratio and simultaneously enables a reproduction of the B(E2;$0$$^{+}_{1}$ → $2$$^{+}_{1}$) excitation strength of 36 Ca. Furthermore, this highlights an important aspect if a new shell-model effective interaction for the region was to be developed on the quest to model the neutron-deficient Ca isotopes and surrounding nuclei whose structure is impacted by proton cross-shell excitations.

20 ≤ A ≤ 38↗

DOE OSTI2023

Aging Mechanisms of Broad Area High-Power ~800nm Laser Diodes

Improved lifetime of high-power broad area laser diodes will enhance their utility for manufacturing, scientific, and medical laser systems. However, factors contributing to gradual degradation of diode laser performance are not fully understood. Here we study the aging mechanisms of ~800 nm aluminum-free laser diodes grown by solid-source MBE. Oxygen was intentionally introduced at three different concentration levels into the quantum well (QW) and waveguide (WG) at concentrations <5×10 15 cm -3 . Diode power, slope efficiency (SE th ), threshold current (I th ), and device parameters such as QW and WG lifetimes were measured at discrete time steps throughout the aging run. The data show that lasing characteristics prior to aging are degraded by oxygen introduction, but the gradual power degradation rate of ~5% over 500 hours at current density 1.74 kA/cm 2 does not change with oxygen concentration. Aging-induced changes in nonradiative lifetimes and threshold were observed for shorter aging times, but stabilized after ~100 hrs. and cannot explain the observed power degradation. This suggests that gradual degradation in these devices is not due to nonradiative recombination at low levels of point defects. The data shows that this degradation results primarily from changes in slope efficiency, and simulation of these results suggests that the power degradation arises from increased intracavity absorption (ICA). Efforts to slow ICA growth, instead of efforts to control low levels of nonradiative recombination centers, may be the most fruitful path forward to improve laser diode lifetime.

42 ENGINEERING↗