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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 991 records · Page 55
All sourcesNASA NTRSDOE OSTI
DOE OSTI2024

Fully ab-initio all-electron calculation of dark matter-electron scattering in crystals with evaluation of systematic uncertainties

We calculate target-material responses for dark matter–electron scattering at the all-electron level using atom-centered Gaussian basis sets. The all-electron effects enhance the material response at high momentum transfers from dark matter to electrons, q ≳ O ( 10 α m e ) , compared to calculations using conventional plane wave methods, including those used in ; this enhances the expected event rates at energy transfers E ≳ 10 eV , especially when scattering through heavy mediators. We carefully test a range of systematic uncertainties in the theory calculation, including those arising from the choice of basis set, exchange-correlation functional, number of unit cells in the Bloch sum, k -mesh, and neglect of scatters with very high momentum transfers. We provide state-of-the-art crystal form factors, focusing on silicon and germanium. Our code and results are made publicly available as a new tool, called (“”). Published by the American Physical Society 2024

Dreyer, Cyrus E.↗
DOE OSTI2015

Significant Reduction of Lattice Thermal Conductivity by the Electron-Phonon Interaction in Silicon with High Carrier Concentrations: A First-Principles Study

The electron-phonon interaction is well known to create major resistance to electron transport in metals and semiconductors, whereas fewer studies are directed to its effect on phonon transport, especially in semiconductors. Herein we calculate the phonon lifetimes due to scattering with electrons (or holes), combine them with the intrinsic lifetimes due to the anharmonic phonon-phonon interaction, all from first principles, and evaluate the effect of the electron-phonon interaction on the lattice thermal conductivity of silicon. Unexpectedly, we find a significant reduction of the lattice thermal conductivity at room temperature as the carrier concentration goes above 1019 cm –3 (the reduction reaches up to 45% in p-type silicon at around 1021 cm –3 ), a range of great technological relevance to thermoelectric materials.

42 ENGINEERING↗
DOE OSTI2016

Interaction of an ultrarelativistic electron bunch train with a W-band accelerating structure: High power and high gradient

Electron beam interaction with high frequency structures (beyond microwave regime) has a great impact on future high energy frontier machines. We report on the generation of multimegawatt pulsed rf power at 91 GHz in a planar metallic accelerating structure driven by an ultrarelativistic electron bunch train. This slow-wave wakefield device can also be used for high gradient acceleration of electrons with a stable rf phase and amplitude which are controlled by manipulation of the bunch train. To achieve precise control of the rf pulse properties, a two-beam wakefield interferometry method was developed in which the rf pulse, due to the interference of the wakefields from the two bunches, was measured as a function of bunch separation. As a result, measurements of the energy change of a trailing electron bunch as a function of the bunch separation confirmed the interferometry method.

Wang, D.↗
DOE OSTI2016

Complete solution of electronic excitation and ionization in electron-hydrogen molecule scattering

The convergent close-coupling method has been used to solve the electron-hydrogen molecule scattering problem in the fixed-nuclei approximation. Excellent agreement with experiment is found for the grand total, elastic, electronic-excitation, and total ionization cross sections from the very low to the very high energies. This shows that for the electronic degrees of freedom the method provides a complete treatment of electron scattering on molecules as it does for atoms.

74 ATOMIC AND MOLECULAR PHYSICS↗
DOE OSTI2017

Spin-Orbit Coupling Controlled J = 3 / 2 Electronic Ground State in 5 d 3 Oxides

Spin-orbit entanglement in 5d-based transition metal oxides (TMOs) has been identified as a route to a host of unconventional physical states including quantum spin liquids, Weyl semimetals, and axion insulators. Yet despite intense interest, no clear rules have emerged for the treatment of spin-orbit coupling (SOC) in 5d TMOs outside of idealised LS or jj coupling paradigms. This is exemplified in 5d 3 oxides in which an orbitally-quenched singlet ground state is anticipated, yet SOC is manifest in the observed magnetic properties. Here we solve this long-outstanding puzzle by revealing that the electronic ground state of Os5+ 5d 3 ions is an unquenched J = 3/2 state. Resonant inelastic x-ray scattering (RIXS) in Ca3LiOsO6 and Ba 2 YOsO 6 exposes a SOC-controlled splitting of the t 2g manifold. The results are successfully described using an intermediate-coupling framework in which oxygen hybridisation promotes the breakdown of the orbital singlet. This framework opens the door to realistic treatment of SOC across a range of 5d TMOs beyond the 5d 3 case.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2022

Control of Grid-Connected Multiport MV Power Electronics Energy Hub: Preprint

In this paper a new concept of multiport modular medium-voltage power electronics hub (M3PE-HUB) is introduced for future power grid. The goal for this project is to design, develop, and demonstrate foundational technologies and capabilities for multiport power electronics energy hubs that can serve as intelligent devices to coordinate and control several different sources and loads. In this paper, the architecture of the controller, the central controls, and its verification is presented.

controls↗
DOE OSTI2019

Ab initio GGA+U investigations of the structural, electronic, and magnetic properties of Cd 1-x Mn x Te alloy

The structural, electronic and magnetic properties of Cd 1-x Mn x Te alloy in the zinc-blende (ZB) phase within the framework of spin-polarized density functional theory using the generalized gradient approximation (GGA) are studied. In particular, we employ GGA+U SIC method that gives a better description of systems with strong Coulomb correlations of the d-electrons. First, we discuss implementation of GGA+U method to the ground state calculations of pure CdTe and ferromagnetic MnTe. The alloy is modelled at some selected compositions by ordered structures described in terms of periodically repeated supercells for the compositions x = 0.25, 0.5, and 0.75. The compositional dependence of the lattice constant, electronic band structure and partial densities of states of ferromagnetic Cd 1-x Mn x Te alloy are studied. We estimate the spin-exchange splitting energies produced by the Mn 3d-states and determine the exchange constants for the conduction and valence bands of the alloy. The energy positions of the occupied and unoccupied Mn 3d-bands in the electronic structure of ferromagnetic Cd 1-x Mn x Te alloy are also presented. Our calculations using GGA+U SIC approach agree well with the available experimental data and other calculations.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2015

Exploration of metastability and hidden phases in correlated electron crystals visualized by femtosecond optical doping and electron crystallography

Characterizing and understanding the emergence of multiple macroscopically ordered electronic phases through subtle tuning of temperature, pressure, and chemical doping has been a long-standing central issue for complex materials research. We report the first comprehensive studies of optical doping–induced emergence of stable phases and metastable hidden phases visualized in situ by femtosecond electron crystallography. The electronic phase transitions are triggered by femtosecond infrared pulses, and a temperature–optical density phase diagram is constructed and substantiated with the dynamics of metastable states, highlighting the cooperation and competition through which the macroscopic quantum orders emerge. These results elucidate key pathways of femtosecond electronic switching phenomena and provide an important new avenue to comprehensively investigate optical doping–induced transition states and phase diagrams of complex materials with wide-ranging applications.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2024

Light-induced electron dynamics of molecules in cavities: comparison of model Hamiltonians

The rapidly expanding field of polaritonic chemistry requires accurate theoretical simulations to understand new phenomena at the atomic scale. Computing the optoelectronic properties of molecules using established electronic structure methods is a careful balance of accuracy and computational expense, and expanding these methods to quantum electrodynamics to describe coupled cavity-molecule systems is an active topic of development. Key to these methods are the Hamiltonian operators representing the photon cavity modes. The recently introduced quantum electrodynamics time-dependent configuration interaction (QED-TDCI) method allows for the combination of electron dynamics simulations with quantum electrodynamics, enabling the simulation of time-dependent optoelectronic properties of cavity-molecule systems. Using this method, a comparison of two many-state QED Hamiltonians—the Pauli-Fierz and quantum Rabi model Hamiltonians—is presented, with a particular focus on time-dependent properties in applied electric fields.

Peyton, Benjamin G. (ORCID:0000000163190751)↗
DOE OSTI2019

The development programme of cathodes and electron guns for the Hollow Electron Lenses of the High Luminosity LHC project1

The High Luminosity LHC project (HL-LHC) foresees the construction and installation of important new equipment to increase the performance of the LHC machine. The Hollow Electron Lens (HEL) is a promising system to control the beam halo. It improves the beam collimation system of the HL-LHC and mitigates possible equipment damage in case of failure scenarios from halo losses. The halo can store up to 30 MJ energy. The specifications for this new device are quite demanding. The source, an electron gun with an annular shaped cathode, has to deliver a current up to 5 A. This is five times higher than the current in the existing electron lenses in Fermi and Brookhaven national laboratories. This note describes the programme carried out to design and test high-perveance guns equipped with two types of high-performance scandate cathodes. The size of the final gun is now considerably smaller than the one of the first prototype, allowing a reduction of diameter and cost of the superconducting magnet system used to steer the electron beam. The tests carried out at FNAL, BVERI and BJUT demonstrated that the developed cathodes fulfil the specifications and can supply a 5 A fully Space Charge Limited (SCL) current.

43 PARTICLE ACCELERATORS↗
DOE OSTI2023

Optimizing the Design Tunes of the Electron Storage Ring of the Electron-Ion Collider

The Electron-Ion Collider (EIC) presently under construction at Brookhaven National Laboratory will collide polarized high energy electron beams with hadron beams with luminosities up to 10^34cm^{-2}s^{-1} in the center mass energy range of 20-140 GeV. Preliminary beam-beam simulations resulted in an optimum working point of (.08, .06) in the Electron Storage Ring (ESR). However, during the ESR polarization simulation study this working point was found to be less than optimal for electron polarization. In this article, we present beam-beam simulation results in a wide range tune scan to search for optimal ESR design tunes that are acceptable for both beam-beam and polarization performances.

43 PARTICLE ACCELERATORS↗
DOE OSTI2026

Extraction and Injection in the Electron Injector for the Electron-Ion Collider

The electron injector for the Electron-Ion Collider (EIC) consists of a linear accelerator, a beam accumulation ring, and the Rapid Cycling Synchrotron (RCS) before the electrons are injected into the Electron Storage Ring (ESR) and collided. Extraction out of the RCS is complicated by limited space and the nominal beam pipe aperture, while injection into the ESR is complicated due to the limitation of kicker strength, so that the kickers will not impact the proton beam in the adjacent Hadron Storage Ring (HSR); additionally, the ESR kickers must also provide enough kick to the stored bunch for the swap-out scheme. This paper covers the injection into and extraction out of the RCS, as well as injection into the ESR, detailing layout, optics, and anticipated parameters of the septa and different kickers.

Deitrick, K. [Thomas Jefferson National Accelerato↗
DOE OSTI2023

Electron cloud thresholds at the arcs of the Electron-Ion Collider hadron storage ring

The Electron-Ion Collider is designed to provide high-luminosity collisions. For the highest lu minosity scenario, the hadron storage ring will host a 275 GeV beam consisting of 1160 bunches with 6.9e10 protons per bunch. Previous work has found that some sections of the hadron storage ring will experience electron cloud buildup if their vacuum chamber does not show a sufficiently low secondary electron emission value. This technical note reviews the electron cloud growth thresholds for the updated screen profile and lattice.

43 PARTICLE ACCELERATORS↗
DOE OSTI2025

Electron cloud predictions for the Hadron Storage Ring of the Electron-Ion Collider and planned mitigations

This paper reports on a collection of electron cloud studies to determine the electron cloud threshold for different sections along the beampipe of the Hadron Storage Ring (HSR) for the Electron-Ion Collider (EIC), presents the results of a study of the interaction of the beam with the electron clouds, and discusses the limitation of potential solutions like scrubbing and Landau damping.

43 PARTICLE ACCELERATORS↗
DOE OSTI2021

Impact of radiation on electronics and opto-electronics

In this chapter we will present the results of the impact of radiation on electronics and opto-electronics for two of the LHC experiments during Run 1 and Run 2. ATLAS results are presented in Section 6.1; CMS in Section 6.2. In Section 6.3 we will present a comparison between the two experiments, highlighting operational guidelines and proposing solutions to build the electronics and opto-electronics of the future LHC experiments.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗
DOE OSTI2023

High-brightness electron injectors for high-duty cycle X-ray free electron lasers

The successful development in the last two decades of X-ray free electron lasers (FELs) with their revolutionary brightness performance has been tightly dependent on the parallel development of electron guns and injectors capable of providing the high-brightness electron beams required by FELs lasing at these short wavelengths. The ultimate brightness delivered by a linear accelerator (linac) is already set at its injector and the remaining part of the accelerator can be only designed to preserve the injector performance. The technology to be used for the accelerator part of an X-Ray FEL strongly depends on the duty-cycle at which the FEL operates. Normal-conducting, room-temperature, copper-based radio frequency (RF) technology is typically used for low duty-cycles of up to approximately 10 −3 . For higher duty-cycles and up to continuous wave (CW) operation, the linac must rely on superconductive RF technology because, with the higher duty-cycle, the increasingly higher power dissipated in normal conducting RF structures becomes excessive for the warm technology. The situation changes in the lower energy part of the accelerator, where injector schemes, based on direct current, normal-conducting, and superconducting RF electron guns, are demonstrating the beam quality performance required by high-duty-cycle X-ray FELs. In this paper we start with a description of the requirements for such injectors, followed by an overview of the pursued technologies and schemes, and by a discussion on the main differences in terms of beam dynamics between low and high duty-cycle injectors.

Sannibale, Fernando↗