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DOE OSTI2025

Advancements in the modification of TiFe alloys for enhanced hydrogen Storage: Strategies and future Directions

Hydrogen is considered a promising clean energy source, and a potential alternative to conventional fossil fuels. TiFe alloy has been particularly interesting due to its ability to reversibly absorb and desorb hydrogen at room temperature and low pressure. The initial hydrogen absorption stage of TiFe alloy requires activation under high-temperature and high-pressure conditions, which hinders its practical application. Here, this paper primarily examines the impact of elemental substitution methods on the hydrogen storage capabilities of TiFe alloys, with a particular emphasis on elucidating the mechanisms associated with various substituent elements. Commonly utilized elements, such as Mn, V, and Zr, significantly improve the activation performance of TiFe alloys. Additionally, the incorporation of elements such as Ni, Cr, Ce, and Y contributes to the modulation of phase composition, as well as the enhancement of activation and kinetic properties. However, there exists a notable deficiency in systematic investigations concerning alternative elements, coupled with a frequent oversight of the preparation process's influence on the hydrogen storage characteristics of these alloys. Consequently, the mechanisms by which different elements affect the hydrogen storage process in TiFe alloys remain inadequately understood among current research, thereby complicating the establishment of experiment-based design guidelines for TiFe alloys. Furthermore, the plasma treatment and high-entropy alloying present new approaches for optimizing the hydrogen storage properties of TiFe alloys. This paper aims to present novel research perspectives and insights to scholars in the field by introducing methods for the modification of TiFe alloys.

Hydrogen storage↗

DOE OSTI2023

High-Performance Skutterudite/Half-Heusler Cascaded Thermoelectric Module Using the Transient Liquid Phase Sintering Joining Technique

Not provided.

Materials Science↗

DOE OSTI2023

Twin-pulse seeding enables pump-probe capabilities in the EUV to soft X-ray spectrum at synchrotron light sources

Having previously reported that separating the two stages of echo-enabled harmonic generation (EEHG) with one or more bending magnet (BM) sections allows the BMs to serve as the desired source of momentum compaction, here we demonstrate that this arrangement can greatly reduce the total energy modulation required by any 4th generation synchrotron light source, leading to higher repetition rates as well as stronger coherent radiation output power, with significant benefits. Since the EEHG beamline performance is mainly determined by the momentum compaction, beam emittances and beta functions of a storage ring lattice, allowing for different separations between the two stages is a straightforward way to increase the momentum compaction of chicane 1. This also enables pump-probe capabilities in a novel context, where twin-pulse seeding on the same electron bunch would allow two distinct radiation pulses with an adjustable delay in the range of 0.1 to 10 ps. In the twin-pulse seeding scheme, the same electron bunch could undergo modulation from two distinct laser pulses. Later stages would produce independent harmonics in subsequent straight sections. There are two variations of this twin-pulse seeding scheme, supporting different scientific applications. With a common modulation in stage 1, the first option allows simultaneously two independent radiation sources, with a full coverage of the EUV (2.5 to 50 nm) to soft X-ray (1.25 to 2.5 nm) spectrum; for the second option, the same stage 2 undulator could generate two coherent pulses both fitting within the FEL bandwidth, or at distinct harmonics. We present particle tracking simulation studies based on the APS-U lattice, including quantum excitation and radiation damping. These simulations indicate that there is no degradation of the modulated longitudinal phase space even when the two stages are separated by as many as 10 BM sections.

36 MATERIALS SCIENCE↗

DOE OSTI2020

Programmable chiral states in flocks of active magnetic rollers

Inspired by nature, active matter exemplified by self-organization of motile units into macroscopic structures holds great promise for advanced tunable materials capable of flocking, shape-shifting, and self-healing. Active particles driven by external fields have repeatedly demonstrated potential for complex self-organization and collective behavior, yet how to guide the direction of their collective motion largely remains unexplored. Here, we report a system of microscopic ferromagnetic rollers driven by an alternating magnetic field that demonstrates programmable control of the direction of a self-organized coherent vortical motion (i.e., chirality). Facilitated by a droplet confinement, the rollers get synchronized and display either right- or left-handed spontaneous vortical motion, such that their moving direction determines the vortex chirality. Here, we reveal that one can remotely command a flock of magnetic rollers to switch or maintain its chiral state by modulating a phase shift of the sinusoidal magnetic field powering the active rollers. Building on our findings, we realize a self-assembled remotely controlled micro-pump architecture capable of switching the fluid transport direction on demand. Our studies may stimulate new design strategies for directed transport and flocking robotics at the microscale based on active colloids.

36 MATERIALS SCIENCE↗

DOE OSTI2022

Multi-pass cell spectral broadening at high pulse energies

We simulate experimental conditions for nonlinear spectral broadening and compression of multi-joule, sub-picosecond, and femtosecond laser systems focusing on 1 μm center wavelength. The spatial, spectral, and temporal properties of two distinct cases are investigated in detail. The first system is a short multi-pass cell with 0.1–0.5 J pulse energy operated at higher helium pressures, used to illustrate the transition between Kerr-effect induced spectral broadening and spectral broadening in plasma. The second case is a long ten-joule multi-pass cell operated at few Pascal pressure range. These examples cover the operational extent of plasma spectral broadening in a multi-pass cell. Here effects pertaining to plasma spectral broadening, including imperfect spatial beam profiles and initial non-zero nonlinear phase, are investigated, as well as scalability.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗

DOE OSTI2021

Measurements of $\overline{\nu}_{\mu}$ and $\overline{\nu}_{\mu} + \nu_{\mu}$ charged-current cross-sections without detected pions or protons on water and hydrocarbon at a mean anti-neutrino energy of 0.86 GeV

We report measurements of the flux-integrated $\overline{\nu}_\mu$ and $\overline{\nu}_\mu+\nu_\mu$ charged-current cross-sections on water and hydrocarbon targets using the T2K anti-neutrino beam with a mean beam energy of 0.86 GeV. The signal is defined as the (anti-)neutrino charged-current interaction with one induced $\mu^\pm$ and no detected charged pion or proton. These measurements are performed using a new WAGASCI module recently added to the T2K setup in combination with the INGRID Proton Module. The phase space of muons is restricted to the high-detection efficiency region, $p_{\mu}>400~{\rm MeV}/c$ and $\theta_{\mu}<30^{\circ}$, in the laboratory frame. An absence of pions and protons in the detectable phase spaces of $p_{\pi}>200~{\rm MeV}/c$, $\theta_{\pi}<70^{\circ}$ and $p_{\rm p}>600~{\rm MeV}/c$, $\theta_{\rm p}<70^{\circ}$ is required. In this paper, both the $\overline{\nu}_\mu$ cross-sections and $\overline{\nu}_\mu+\nu_\mu$ cross-sections on water and hydrocarbon targets and their ratios are provided by using the D’Agostini unfolding method. The results of the integrated $\overline{\nu}_\mu$ cross-section measurements over this phase space are $\sigma_{\rm H_{2}O}=(1.082\pm0.068(\rm stat.)^{+0.145}_{-0.128}(\rm syst.)) \times 10^{-39}\,{\rm cm^{2} / nucleon}$, $\sigma_{\rm CH}=(1.096\pm0.054(\rm stat.)^{+0.132}_{-0.117}(\rm syst.)) \times 10^{-39}\,{\rm cm^{2} / nucleon}$, and $\sigma_{\rm H_{2}O}/\sigma_{\rm CH} = 0.987\pm0.078(\rm stat.)^{+0.093}_{-0.090}(\rm syst.)$. The $\overline{\nu}_\mu+\nu_\mu$ cross-section is $\sigma_{\rm H_{2}O} = (1.155\pm0.064(\rm stat.)^{+0.148}_{-0.129}(\rm syst.)) \times 10^{-39}\,{\rm cm^{2} / nucleon}$, $\sigma_{\rm CH}=(1.159\pm0.049(\rm stat.)^{+0.129}_{-0.115}(\rm syst.)) \times 10^{-39}\,{\rm cm^{2} / nucleon}$, and $\sigma_{\rm H_{2}O}/\sigma_{\rm CH}=0.996\pm0.069(\rm stat.)^{+0.083}_{-0.078}(\rm syst.)$.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

DOE OSTI2021

Quantum optimal control of ten-level nuclear spin qudits in Sr 87

We study the ability to implement unitary maps on states of the I = 9 / 2 nuclear spin in Sr 87 , a d = 10 dimensional (qudecimal) Hilbert space, using quantum optimal control. Through a combination of nuclear spin resonance and a tensor ac Stark shift, by solely modulating the phase of a radio-frequency magnetic field, the system is quantum controllable. Alkaline-earth-metal atoms, such as Sr 87 , have a very favorable figure of merit for such control due to narrow intercombination lines and the large hyperfine splitting in the excited states. We numerically study the quantum speed limit, optimal parameters, and the fidelity of arbitrary state preparation and full SU(10) maps, including the presence of decoherence due to optical pumping induced by the light-shifting laser. We also study the use of robust control to mitigate some dephasing due to inhomogeneities in the light shift. We find that with an rf Rabi frequency of Ω rf and 0.5% inhomogeneity in the the light shift we can prepare an arbitrary Haar-random state in a time T = 4.5 π / Ω rf with average fidelity ( F ψ ) = 0.9992 , and an arbitrary Haar-random SU(10) map in a time T = 24 π / Ω rf with average fidelity ( F U ) = 0.9923 .

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

DOE OSTI2023

Lamellar fluctuations melt ferroelectricity.

We consider a standard Ginzburg-Landau model of a ferroelectric whose electrical polarization is coupled to gradients of elastic strain. At the harmonic level, such flexoelectric interaction is known to hybridize acoustic and optic phonon modes and lead to phases with modulated lattice structures that precede the state with spontaneously broken inversion symmetry. Here, we use the self-consistent phonon approximation to calculate the effects of thermal and quantum polarization fluctuations on the bare hybridized modes to show that such long-range modulated order is unstable at all temperatures. We discuss the implications for the nearly ferroelectric SrTiO3 and KTaO3, and we propose that these systems are melted versions of an underlying modulated state that is dominated by nonzero momentum thermal fluctuations except at the very lowest temperatures.

Guzman-Verri, G. G.↗

DOE OSTI2023

Confidentiality-preserving machine learning algorithms for soft-failure detection in optical communication networks

Automated fault management is at the forefront of next-generation optical communication networks. The increase in complexity of modern networks has triggered the need for programmable and software-driven architectures to support the operation of agile and self-managed systems. In these scenarios, the European Telecommunications Standards Institute zero-touch network and service management approach is imperative. The need for machine learning algorithms to process the large volume of telemetry data brings safety concerns as distributed cloud-computing solutions become the preferred approach for deploying reliable communication network automation. This paper’s contribution is twofold. First, we propose a simple yet effective method to guarantee the confidentiality of the telemetry data based on feature scrambling. The method allows the operation of third-party computational services without direct access to the full content of the collected data. Additionally, the effectiveness of four unsupervised machine learning algorithms for soft-failure detection is evaluated when applied to the scrambled telemetry data. The methods are based on factor analysis, principal component analysis, nonlinear principal component analysis, and singular value decomposition. Most dimensionality reduction algorithms have the common property that they can maintain similar levels of fault classification performance while hiding the data structure from unauthorized access. Evaluations of the proposed algorithms demonstrate this capability.

97 MATHEMATICS AND COMPUTING↗

DOE OSTI2025

Overcoming energy limitation in post-compression of picosecond pulses by free beam propagation in air and temporal pulse splitting and recombining

Cryogenically cooled diode-pumped Yb:YAG has been demonstrated to efficiently generate pulses of >1 J energy and several picoseconds duration at a kilohertz repetition rate. Pulse broadening and post-compression techniques capable of operating at these high pulse energies will expand the use of these lasers in applications requiring shorter pulses. Towards this goal, we demonstrate the post-compression of 5.5 ps pulses with energy in the 0.1 J range by spectral broadening of self-collimated large area beams in air. In proof-of-principle experiments, pulses of 65 mJ energy from a cryogenically cooled Yb:YAG laser were compressed to 1.1 ps after 65 m propagation in a compact setup in which the beam was folded using flat mirrors. Further energy scaling was demonstrated by combining this spectral broadening technique with temporal pulse splitting and recombining. 120 mJ pulses were split into two pulses and coherently recombined with 85% efficiency after 50 m of propagation in air to yield 1.4 ps pulses.

High Energy Laser↗

DOE OSTI2025

Pathways for Nucleation and Growth in Confined Spaces and at Interfaces

Mineral crystallization is central to myriad natural processes from the formation of snowflakes to stalagmites, but the molecular-scale mechanisms are often far more complex than models reflect. Feedbacks between the hydro-, bio-, and geo-spheres drive complex crystallization processes that challenge our ability to observe and quantify them, motivating an expansion of crystallization theories. Here, in this article, we discuss how the driving forces and timescales of nucleation are influenced by factors ranging from simple geometric confinement to distinct interfacial solution structures involving solvent organization, electrical double layers, and surface charging effects. Taken together, these ubiquitous natural phenomena can preserve metastable intermediates, drive precipitation of undersaturated phases, and modulate crystallization in time and space.

biosphere↗

DOE OSTI2024

Performance Analysis of Phase 2 Tracker Upgrade Ps Module before and after Irradiation

The Large Hadron Collider will undergo a luminosity upgrade targeting a peak instantaneous luminosity ranging from 5–7.5×1034 cm−2s−1. The ambitious goal of the High Luminosity LHC is to achieve a total of 3000–4000 fb−1 of proton-proton collisions at a center-of-mass energy of 13–14 TeV by 2029. To cope with such challenging environmental conditions, the outer tracker of the CMS experiment will be upgraded using closely spaced silicon sensors (pixels and strips) to provide tracking information at the Level-1 trigger. A PS-Module, composed of both a pixel and a strip sensor, was tested at the Fermilab Test-Beam Facility to evaluate its ability to provide accurate tracking information, Pt discrimination capabilities, and optimal performance at the irradiation levels expected after being exposed to the harsh conditions of the High Luminosity LHC. The results of the test and the comparison of the module performance before and after irradiation will be presented in this poster

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

DOE OSTI2022

Medium voltage planar DC bus distributed capacitor array

An inverter with a modular bus assembly is described. In various embodiments, the modular bus assembly includes a laminated motherboard and a plurality of capacitor daughtercards. The laminated motherboard can be configured to interface a plurality of phase-leg modules and a plurality of capacitor daughtercards through a plurality of terminals and connectors located on a bottom side or a top side of the laminated motherboard. The laminated motherboard includes a layer stack with a plurality of conductor layers. Each of the plurality of conductor layers is implemented with a net spacing from a neighboring plated through hole (PTH) based at least in part on differences in potential to be applied to each of the plurality of conductor layers as compared to a potential to be applied to the PTH. Embedded shield polygons can be implemented on the laminated motherboard to mitigate surface discharge at surface terminal (PTH/SMT) triple junctions.

Ravi, Lakshmi↗

DOE OSTI2022

Neutrino Hunting: Looking through a UV Lens Scintillation Photon Detection in a Large-Volume Liquid Argon Time Projection Chamber, Exposed to a Multi-GeV Charged Particle Beam

The Deep Underground Neutrino Experiment (DUNE) will be a world-class neutrino observatory and nucleon decay detector designed to answer fundamental questions about elementary particles and their role in the universe. The DUNE experiment will consist of a a Near Detector, located at Fermilab, and a Far Detector, approximately 1.5~km underground at the Sanford Underground Research Facility in South Dakota, located $\sim$1300~km away. The accelerator complex at Fermilab will host an intense beam of neutrinos directed toward the two detectors. My dissertation centers on the implementation of technologies used to detect scintillation photon signals in liquid argon in the context of the DUNE's Far Detector Single-Phase (SP) module design, and features direct contributions to the Photon Detection System (PDS) deployed in the ProtoDUNE-SP Large-Volume Liquid Argon Time Projection Chamber (LArTPC) prototype. The PDS is needed for non-beam event timing, such as atmospheric neutrinos, proton d ecay, and supernova detection. The PDS provides a prompt signal ($t_{0}$ information) for micro-second event time determination, which improves the TPC's spatial localization along drift direction, enables accurate ionization-signal-attenuation determination, and even provides calorimetry. My dissertation will discuss an overview of the DUNE and ProtoDUNE-SP experiment and how we detect neutrinos in LAr, via charge and scintillation light. It will discuss my core experimental and analysis work, in regards to the Photon Detection System; including my contributions in establishing procedures for the commissioning and integration for the Photon Detector System that will be valuable during the construction, installation, commissioning, and operations of the DUNE Far Detector. In addition, it will comprehensively discuss the capability of three different photon detection technologies, and their characteristics and responses to muon and electron beam particles over a range of beam momenta , from 0.3~GeV/$c$ - 7~GeV/$c$. Further, the overall progress detailed in this thesis will help pave the way toward understanding the physical properties of these detectors, which will contribute to the success of the sensitivity measurements required for determining the neutrino mass hierarchy and $\delta_{CP}$.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗

DOE OSTI2024

Performance Analysis of Phase 2 Tracker Upgrade PS Module Before and After Irradiation

The Large Hadron Collider will undergo a luminosity upgrade targeting a peak instantaneous luminosity ranging from 5 up to 7.5$\times10^{34}$\,cm$^{-2}$s$^{-1}$. The ambitious goal of the High Luminosity LHC is to achieve a total of 3000--4000\,fb$^{-1}$ of proton-proton collisions at a center-of-mass energy of 14\,TeV. To cope with such challenging environmental conditions, the outer tracker of the CMS experiment will be upgraded using closely spaced silicon sensors (pixels and strips) to provide tracking information at the Level-1 trigger. A PS-Module, composed of both a pixel and a strip sensor, was tested at the Fermilab Test-Beam Facility to evaluate its ability to provide accurate tracking information, particle momentum discrimination capabilities and optimal performance at the irradiation levels expected after being exposed to the harsh conditions of the High Luminosity LHC. The results of the test and the comparison of the module performance before and after irradiation will be presented in this poster.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

DOE OSTI2024

Performance Analysis of Phase 2 Tracker Upgrade PS Module Before and After Irradiation

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

DOE OSTI2026

Extension of Clad Damage Propagation Model for Fission Gas Dispersal and Two-Phase Flow Effects in MOOSE SubChannel Module

This report presents an extension of the Clad Damage Propagation (CDAP) model implemented in the MOOSE SubChannel Module (SCM) to capture post-failure fission-gas dispersal and two-phase flow effects in sodium-cooled fast reactor assemblies. The extended model tracks discharged gas axially and radially, computes channel-averaged flow quality and void fraction using a Lockhart–Martinelli framework, evaluates two-phase frictional pressure-drop multipliers, determines inlet mass-flow degradation under fixed core pressures, and applies an intensified-void-based heat-transfer degradation to affected fuel pins. Radial plume expansion is parameterized using mineral-oil jet experiments mapped to sodium conditions via Reynolds–Weber similarity. Implementation details are documented, along with the new methods and user inputs needed to control plume mapping and two-phase behavior. Demonstration simulations for 19- and 37-pin bundles show that breach size and inlet velocity strongly influence propagation potential: small breaches (≤0.5 mm) produce limited degradation while larger breaches (~1 mm) can drive oscillatory temperature spikes and enhanced failure propagation, especially at higher velocities. These results demonstrate that the extended CDAP model provides a more complete framework for quantifying cladding damage propagation and evaluating propagation potential in transient scenarios. The approach remains computationally efficient, consistent with subchannel-level analysis, yet incorporates sufficient physics to bridge localized post-failure effects with bundle- and assembly-scale degradation.

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

DOE OSTI2020

Identity of the JET M-mode and the ASDEX Upgrade I-phase phenomena

An H-mode plasma state free of edge-localized mode (ELM), close to the L-H transition with clear density and temperature pedestal has been observed both at the Joint European Torus (JET) and at the ASDEX Upgrade (AUG) tokamaks usually identified by a low frequency (LFO, 1–2 kHz), m = 1, n = 0 oscillation of the magnetics and the modulation of pedestal profiles. The regime at JET is referred to as M-mode while at AUG as intermediate phase or I-phase. This contribution aims at a comparative analysis of these phenomena in terms of the density and temperature pedestal properties, the magnetic oscillations and symmetries. Lithium beam emission spectroscopy (Li-BES) and reflectometer measurements at JET and AUG show that the M-mode and the I-phase modulates the plasma edge density. A high frequency oscillation of the magnetics and the density at the pedestal is also associated with both the M-mode and the I-phase, and its power is modulated with the LFO frequency. The power modulation happens simultaneously in every Mirnov coil signal where it can be detected. The bursts of the magnetic signals and the density at the pedestal region are followed by the flattening of the density profile, and by a radially outward propagating density pulse in the scrape-off layer (SOL). The analysis of the helium line ratio spectroscopy (He-BES) signals at AUG revealed that the electron temperature is modulated in phase with the density, thus the I-phase modulates the pressure profile gradient. Overall, this analysis gave opportunity to compare Li-BES and He-BES density profiles at different locations suggesting a toroidal and poloidal symmetry of the density modulation. The presented results indicate that the regimes, the AUG I-phase and the JET M-mode, exhibit similar characteristics, which leads to the conclusion that the regimes are likely the same.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗