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Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.

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At least 127 records · Page 7
All sourcesNASA NTRSDOE OSTI
DOE OSTI2022

An Integrated Theoretical and Experimental Approach to Achieve Highly Polarizable Relaxor Ferroelectric Liquid Crystalline Polymers

In this project, we have designed and synthesized a series of aliphatic sulfonlyated chiral and achiral polyether. The major objective is to achieve ferroelectric liquid crystalline polymers with a high spontaneous polarization (0.04-0.08 C/m2). Due to the strong dipole-dipole interaction among the sulfonyl side groups, which resembles that among water molecules, these polyethers can exhibit various liquid crystalline self-assemblies without any rigid mesogens. By tuning the position of the sulfonyl groups, single versus double sulfonyl groups, and spacer/tail length and methyl branches, the liquid crystalline phases include smectic A, smectic C, and hexagonal columnar phases. When the single sulfonyl group is next to the main chain or disulfonyl groups are separated by a short C3 spacer, the dipolar interaction is too strong to allow any dipole switching. As a result, the linear dielectric behavior is observed with a low dielectric constant of 5-7. When the single sulfonyl groups are away from the main chain, the paraelectric behavior is obtained with a high dielectric constant around 20. From this study, we predict that by further tailoring the intermolecular interactions among the disulfonyl side groups, it is possible to achieve ferroelectric property for these liquid crystalline polymers. If successful, these ferroelectric liquid crystalline polymers can be used for efficient electrocaloric cooling applications.

36 MATERIALS SCIENCE↗
DOE OSTI2023

Goldstone bosons and fluctuating hydrodynamics with dipole and momentum conservation

We develop a Schwinger-Keldysh effective field theory describing the hydrodynamics of a fluid with conserved charge and dipole moments, together with conserved momentum. The resulting hydrodynamic modes are highly unusual, including sound waves with quadratic (magnon-like) dispersion relation and subdiffusive decay rate. Hydrodynamics itself is unstable below four spatial dimensions. We show that the momentum density is, at leading order, the Goldstone boson for a dipole symmetry which appears spontaneously broken at finite charge density. Unlike an ordinary fluid, the presence or absence of energy conservation qualitatively changes the decay rates of the hydrodynamic modes. This effective field theory naturally couples to curved spacetime and background gauge fields; in the flat spacetime limit, we reproduce the “mixed rank tensor fields” previously coupled to fracton matter.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2025

Electric dipole polarizability of 58 Ni

The electric dipole strength distribution in 58 Ni between 6 and 20 MeV has been determined from proton inelastic scattering experiments at very forward angles at RCNP, Osaka. The experimental data are rather well reproduced by quasiparticle random-phase approximation calculations including vibration coupling, despite a mild dependence on the adopted Skyrme interaction. They allow an estimate of the experimentally inaccessible high-energy contribution above 20 MeV, leading to an electric dipole polarizability α D ⁡ ( 58 Ni) = 3.48 (31)⁢ fm 3 . This serves as a test case for recent extensions of coupled-cluster calculations with chiral effective field theory interactions to nuclei with two nucleons on top of a closed-shell system.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2024

Cooper minima in high-Z atoms: effects of correlation and relativity on np photoionization

Abstract Photoionization dipole transition matrix elements pass through a zero or attain a minimum that leaves imprints on photoionization parameters like the cross-section, angular distribution asymmetry parameter, phase shift, and photoionization time delay. This minimum is commonly known as the ‘Cooper minimum’ (CM). The CM, in general, is strongly affected by relativistic and correlation effects. Previous works investigated CM in the 6pand 5psubshell photoionization up toZ= 100 using the single-particle Dirac-Slater (DS) method. The present work extends the earlier work toZup to 120 using more accurate methods; Dirac–Hartree–Fock (DHF) which includes the relativistic effects and exchange correlations, and the relativistic random phase approximation (RRPA) which includes both initial and final state electron-electron correlations along with relativistic effects. In addition to the study of photoionization from the 6pand 5psubshells, the 4psubshell has also been investigated in the present work. To demonstrate the prominent effects in the high-Z atoms, Rn (Z= 86), Ra (Z= 88), No (Z= 102), Cn (Z = 112), Og (Z= 118), and Ubn (Z= 120) are investigated.

Optics↗
DOE OSTI2021

A Full-length Quench Antenna for MQXFA Production Series Quadrupole Magnet Testing

The MQXFA production series quadrupoles being built for the Hi-Lumi (HL) LHC upgrade by the US Accelerator Upgrade Project (US-HL-LHC AUP) will have very limited instrumentation for characterizing quench events that occur during magnet training and performance validation testing. In order to understand the origin of the quenches, and whether they have some implication for ongoing magnet fabrication, it was decided to build a full-length Quench Antenna (QA) with axial resolution of 50mm to be employed during cold testing in the anticryostat used for magnetic measurements. The goal is to have fineresolution, full-length coverage detection of quench events axially, as well as to have azimuthal resolution on the order of the cable width (about 1 degree for the cross-section), in a device that can be used both for vertical and horizontal testing. To achieve this, a 5m long QA with 128 channels of high-speed data acquisition has been designed and fabricated. The cylindrical antenna features an array of 12 full-length, dipole- and quadrupole-bucked coils positioned radially in the QA interior for azimuthal localization, and over 100 individual channels of short, high-sensitivity, antennas etched as flexible PCB circuits (which also buck dipole and quadrupole fields) wrapped circumferentially on the cylinder exterior in steps of 50mm along the magnet length for axial detection. This report discusses the design, construction and analysis of the MQXFA QA, and first results from using the antenna during quench testing in the production magnets.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2025

Ultrafast Electron–Dipole Interactions in TeO- Photodetachment

We present direct experimental evidence of ultrafast coupling between ejected electrons and dynamically forming dipole moments in TeO, captured during the photodetachment of TeO?. By combining high-resolution cryogenic photoelectron spectroscopy with velocity-map imaging, we assess previously inaccessible excited states and resolve rich photoelectron angular distributions (PADs) that encode electron–dipole interactions. Systematic comparison of PADs from femtosecond and picosecond lasers reveals striking deviations from free-electron behavior, representing direct evidence of a transient dipole moment evolving on femtosecond timescales. Quantitative analysis pinpoints the dipole buildup time to be within ~60 fs, providing real-time access to the birth of a molecular dipole field. This work establishes a general approach to probing electron-dipole interactions in their formation stages, offering fundamental insights into the ultrafast interplay between departing electrons and transient polar systems — a process that lies at the core of atomic, molecular, and ultrafast physics.

Yang, Fan↗
DOE OSTI2022

Engineering the radiative dynamics of thermalized excitons with metal interfaces

As a platform for optoelectronic devices based on exciton dynamics, monolayer transition metal dichalcogenides (TMDCs) are often placed near metal interfaces or inside planar cavities. While the radiative properties of point dipoles at metal interfaces has been studied extensively, those of excitons, which are delocalized and exhibit a temperature-dependent momentum distribution, lack a thorough treatment. Here, we analyze the emission properties of excitons in TMDCs near planar metal interfaces and explore their dependence on exciton center-of-mass momentum, transition dipole orientation, and temperature. Defining a characteristic energy scale k B T c = ($\hbar k$) 2 /2m (k being the radiative wavevector and m the exciton mass), we find that at temperatures T $\gg$ T c and low densities where the momentum distribution can be characterized by Maxwell-Boltzmann statistics, the modified emission rates (normalized to free space) behave similarly to point dipoles. This similarity in behavior arises due to the broad nature of wavevector components making up the exciton and point dipole emission. On the other hand, the narrow momentum distribution of excitons for T < T c can result in significantly different emission behavior as compared to point dipoles. These differences can be further amplified by considering excitons with a Bose Einstein distribution at high phase space densities, such as in a condensate phase. We find suppression or enhancement of emission relative to the point dipole case by several orders of magnitude. These insights can help optimize the performance of optoelectronic devices that incorporate 2D semiconductors near metal electrodes and can inform future studies of exciton radiative dynamics at low temperatures. Additionally, these studies show that nanoscale optical cavities are a viable pathway to generating long-lifetime exciton states in TMDCs.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2026

Nanoscale Imaging of Magnetotransport around a Circular 𝑝−𝑛 Junction in Graphene

Magnetoresistance studies of 2D systems are often shaped by the motion of electrons that occupy spatially confined wave functions, such as topological edge modes and disorder-induced bound states. Directly probing how such states form and behave in situ , under applied currents, provides a clear way of connecting microscopic physics to the macroscopic transport response. Here, in this Letter, scanning tunneling potentiometry is used to probe the local, current-induced electrochemical potential of carriers in graphene near circular 𝑝−𝑛 junctions in an out-of-plane magnetic field ranging from 0 to 1.4 T. These measurements provide detailed information about the motion of carriers at the nanometer scale, revealing how it evolves with increasing field. The electrochemical potential displays distinct patterns, such as dipoles, spirals, and concentric disks in weak, moderate, and high fields, respectively. The size and orientation of these patterns can be used to understand how local carrier dynamics change in different transport regimes as well as to directly extract physical parameters such as the electron mean free path and cyclotron diameter.

36 MATERIALS SCIENCE↗
DOE OSTI2021

Improved Light Extraction by Engineering Molecular Properties of Square Planar Phosphorescent Emissive Materials

The ultimate objective of this project was to develop a cost-effective technology which could significantly improve the light outcoupling efficiency up to 70% and higher and the key tasks were listed as follows: (i) improving light extraction efficiency through a better control of horizontally aligned emitting dipoles of square planar phosphorescent emitters; (ii) fabricating high-efficiency monochromic and amber OLED in the device settings; (iii) fabricating high-efficiency white OLED in the device settings. With both materials innovation and device structure optimization, we realized OLEDs with an EQE of 66% with a LT 95 lifetime of over 100 khrs at a brightness of 1,000 cd/m 2 . This proposed research is a high impact project which could potentially revolutionize OLED lighting technology and expedite the commercialization process of OLED technology for solid state lighting. This project outcomes contributed to meet the targeted performance of organic solid state lighting set in the DOE MYPP.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Computing real time correlation functions on a hybrid classical/quantum computer

Quantum devices may overcome limitations of classical computers in studies of nuclear structure functions and parton Wigner distributions of protons and nuclei. In this talk, we discuss a worldline approach to compute nuclear structure functions in the high energy Regge limit of QCD using a hybrid quantum computer, by expressing the fermion determinant in the QCD path integral as a quantum mechanical path integral over 0 + 1-dimensional fermionic and bosonic world-lines in background gauge fields. Our simplest example of computing the well-known dipole model result for the structure function F 2 in the high energy Regge limit is feasible with NISQ era technology using few qubits and shallow circuits. We note this example can be scaled up in complexity and extended in scope to compute structure functions, scattering amplitudes and other real-time correlation functions in QCD, relevant for example to describe non-equilibrium transport of quarks and gluons in a Quark-Gluon-Plasma.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2024

Ultrafast and Highly Collimated Radially Polarized Photons at Room Temperature from a Colloidal Quantum Dot Coupled to a Hybrid Nanoantenna

To harness the potential of radially polarized photons for classical and quantum communication applications, we demonstrate an on-chip, room-temperature device, which generates highly directional radially polarized photons at very high rates. The photons are emitted from a giant CdSe/CdS colloidal quantum dot (gQD) accurately positioned at the tip of a metal nanocone centered inside a hybrid metal-dielectric bullseye antenna. We show that due to the large and selective Purcell enhancement specifically for the out-of-plane optical dipole of the gQD, the emitted photons can have a very high degree of radial polarization (>93%), based on a quantitative metric. Our study emphasizes the importance of accurate gQD positioning for optimal radial polarization purity through extensive experiments and simulations, which contribute to the fundamental understanding of radial polarization in nanostructured devices and pave the way for implementation of such systems in practical applications using structured quantum light.

36 MATERIALS SCIENCE↗
DOE OSTI2021

Orbital-resolved calculations of two-center interferences in linear triatomic molecules

In this report we perform ab initio calculations of high-harmonic spectroscopy (HHS) of two-center interference phenomena in oriented carbon-dichalcogen molecules, using time-dependent density functional theory (TDDFT). We show that by resolving the harmonic response into contributions from individual Kohn-Sham orbitals, we can extract target-specific characteristics for both the spectral amplitude and phase. We also discuss that this extraction is predicated on a careful analysis and normalization of the harmonic spectrum. Finally, we present field-free scattering calculations that mimic the recollision step in high-order-harmonic generation and allow the calculation of recombination dipole matrix elements without explicitly calculating the scattering states of a molecule. We show that the orbital-resolved TDDFT HHS results and results based on our field-free scattering calculations are in very good agreement with each other.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2024

Modeling of Bi-2212 strand and Rutherford cable in a dipole coil insert

The U.S. Magnet Development Program (US-MDP) explores high-field accelerator magnets compatible with op- erational conditions beyond the limits of Nb3Sn technology. The ongoing R&D High-Temperature Superconductors (HTS) suggests using Bi2Sr2CaCu2O8−x (Bi-2212) as superconducting element. Bi-2212 Rutherford cables maintain a high critical current (IC ) when exposed to a large external magnetic field. However, Bi-2122 exhibits an oversensitive stress-strain response when subject to large Lorentz forces. This paper reports on the magnetic and mechanical analysis of the Bi-2212 cosine-theta insert being developed at Fermilab for a hybrid magnet composed of 2 external layers of Nb3Sn and 2 internal layers of Bi-2212. We performed a FEM analysis of the insert to estimate the HTS stress state in the coil s strands under magnetic and mechanical loads.

D'Agliano, A.↗
DOE OSTI2019

New Approach and Test Facility for High Field Accelerator Magnets R&D

This paper presents a new approach for developing and demonstrating high field magnet technology based on a magnet and test facility developed specifically for it. The traditional approach for carrying out high field magnet R&D has been building a new magnet to demonstrate a new design, new material or new technology. However, building a high field magnet is time consuming and expensive. To overcome this limitation, Brookhaven National Laboratory (BNL) built and successfully tested a 10 T Nb 3 Sn dipole DCC017 with large enough open or clear space (31 mm wide and 338 mm high) so that a pair of racetrack coils could be inserted into this opening without disassembling the magnet. The motivation be-hind this design was to facilitate a magnet R&D program where the new coils (with a large range in width and height accommodated) would reside in a high field region in direct contact with the existing coils (just as other magnet coils) and thus become an integral part of the magnet. We summarize the approach, the magnet, the test facility, past experiences, current and future test plans and planned up-grade. Here, the magnet facility is now available to service the needs of the wider community for testing cable and insert coils in a back-ground field of up to 10 T.

43 PARTICLE ACCELERATORS↗
DOE OSTI2023

ESR Dipole Power Supply Current Ripple and Noise Specifications

This note presents key findings for the ESR main magnet dipole power supplies (PS), where we find the current ripple specification to be close to or beyond the state-of-the-art. These specifications originate from beam-beam considerations, with the requirement to limit the ripple-induced hadron emittance growth to below 10%/hour. Beam dynamics that drive this PS ripple specification arise from the beam motions at the Interaction Point (IP). The frequency of the motions can be separated into "low", compared to the betatron frequency, and "high", i.e. around the betatron frequency and harmonics. In terms of the driving frequency, "low" implies ƒ<<ƒ 0 v x,y and "fast" means ƒ≈{ƒ 0 v x,y , ƒ 0 (1- v x,y , etc.}, where ƒ 0 =1/ T 0 =78.2 kHz is the revolution frequency, and v x,y are the fractional parts of the betatron tunes. Frequencies higher than ƒ 0 /2 will be folded back due to the particles sampling the field once per turn. To provide flexibility for future lattice adjustments and working point variations, we do not consider the tunes as fixed. Instead, we assume a certain margin and allow them to potentially fall within the range of 0.1< v x,y <0.5. In other words, the high-frequency region spans approximately from 8kHz to 40 kHz. Consequently,, we definte the dipole PS ripple in two distinct frequency ranges: the low-frequency range of [1-8000] Hz and the high-frequency range of [8-40] kHz. For the physics effects we analyzed in this note, there is no distinction between the ripple (which can be approximately reproduced in the frequency domain) and the random noise if both have some power within the frequency bandwidth of interest. Therefore, while we will use the term "ripple" for short, it should always be understood that we are referring to "ripple plus noise." Except for the lower end of the low-frequency range, the impact of the rippling PS current on the beam will be considerably reduced due to the eddy currents induced in the walls of the vacuum chamber. We will account for this effect in the PS ripple specifications to follow. The remaining sections of this note are structure as follows: Section II outlines the beam-beam physics requirements for the positional stability of the beam at the IP. Section III describes the anticipated shielding effect of the eddy currents induced in the vacuum chamber. Section IV derives the ripple requirement for the low-frequency range by propagating the closed orbit ripple resulting from the rippling dipoles to the IP (relevant lattice simulation results are summarized in the Appendix). In Section V, we present the analytical criterion for the ripple in the high-frequency range by considering resonant oscillations of the electron beam around a stable closed orbit near the betatron frequency. Finally, Section VI provides a summary of our findings and discusses related work.

43 PARTICLE ACCELERATORS↗
DOE OSTI2024

FEM Analysis of Hybrid LTS/HTS Cos-Theta Dipole Magnet With Heterogeneous Cable Model

The Lawrence Berkeley National Laboratory (LBNL) and the National High Magnetic Field Laboratory (NHMFL) have published results on Bi-2212 superconductive magnets realized and tested in the canted cosine-theta and solenoid designs, respectively. Fermilab is now preparing for the assembly of the first Bi-2212 stress-managed cosine-theta insert magnet. The insert will be part of the first hybrid cosine-theta magnet made of Nb$_3$Sn outer layers within the US-MDP effort to reach a 20 T bore field. This paper presents the analytical analysis of the cosine-theta Nb$_3$Sn/Bi-2212 hybrid magnet. We report the parameters, logic, and implementation method of the 2D electromagnetic and mechanical FEM analysis of the LTS/HTS hybrid magnet. Results from a detailed heterogeneous model are compared to the homogeneous model implemented in the past. A Python code has been developed to simulate the current degradation due to stresses in the detail-modeled conductor areas. The current degradation has been introduced in the simulation dynamics for the HTS conductor as an iteration process, updating the input load of Lorentz forces of the energization at each step. The magnetic and mechanical analysis results of the 2D cosine-theta LTS/HTS dipole magnet have been described and analyzed.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2021

Probing the Dipole-Bound State in the 9-Phenanthrolate Anion by Photodetachment Spectroscopy, Resonant Two-Photon Photoelectron Imaging, and Resonant Photoelectron Spectroscopy

Valence-bound anions with a dipolar core can support dipole-bound states (DBSs) below the electron detachment threshold. The highly diffuse DBS observed is usually of σ symmetry with an s-like orbital. Recently, a π-type DBS was observed experimentally in the 9-anthrolate anion (9AT – ) and it was shown to be stabilized due to the large anisotropic polarizability of the 9AT core. To confirm the general existence of π-DBS and its structural dependence, here we report an investigation of the 9-phenanthrolate anion (9PT – ), which has a different structure and lower symmetry than 9AT – . Photodetachment spectroscopy revealed a DBS 257 cm -1 below the detachment threshold of 9PT – at 19,627 cm -1 (2.4334 eV). Resonant two-photon photoelectron imaging indeed showed a π symmetry for the DBS. Similar to that observed in 9AT – , the π-DBS in 9PT – is also stabilized by the anisotropic polarizability of the 9PT core and accessed via non-adiabatic population transfer from the initially populated σ-DBS. Photodetachment spectroscopy unveiled nine above-threshold vibrational resonances of the DBS, resulting in nine highly non-Franck-Condon resonant photoelectron spectra by tuning the detachment laser to the vibrational resonances. In conclusion, the combination of photodetachment spectroscopy and resonant photoelectron spectroscopy allowed frequencies for nine vibrational modes of the 9-phenathroxy radical to be measured, including the six lowest frequency bending modes.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2021

Evolution of the superconducting properties from binary to ternary APC-Nb 3 Sn wires

We present a study conducted on binary Tube Type and ternary powder-in-tube Nb 3 Sn wires manufactured using the artificial pinning centres-internal oxidation method. All the specimens are doped with Zr: oxide nano-particles of this element are responsible for the pinning improvement, both by refining the A-15 grain-size and their own point-pinning contribution. Low-field J c magnetometry confirms that the hadron-hadron Future Circular Collider (FCC-hh) specifications are met by one ternary doped-sample. The differences in microstructure were assessed by scanning electron microscopy/transmission electron microscopy to clarify the reasons for the pinning improvement between the two generations. The deviations from the Dew Hughes model are also discussed, underlying some non-linear addition due to competition between the two pinning mechanisms. Finally, we show how the introduction of Ta as a ternary addition influences the A-15 phase by focusing on the radial inhomogeneities, evaluating the T c distribution and Sn composition gradients. The latter are used to model the currents, enabling us to evaluate the individual weights of the pinning mechanisms and their absolute contributions at the High Luminosity-Large Hadron Collider and FCC-hh dipoles operational points.

43 PARTICLE ACCELERATORS↗