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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 451 records · Page 25
All sourcesNASA NTRSDOE OSTI
DOE OSTI2023

The contribution of Compton ionization to ultrafast x-ray scattering

We investigate the role of Compton ionization in ultrafast non-resonant x-ray scattering using a molecular model system, which includes the ionization continuum via an orthonormalized plane wave ansatz. Elastic and inelastic components of the scattering signal, as well as coherent-mixed scattering that arises from electron dynamics, are calculated. By virtue of a near-quantitative distinction between scattering related to electronic transitions into bound and continuum states, we demonstrate how Compton ionization contributes to the coherent-mixed component. Analogous to inelastic scattering, the contribution to the coherent-mixed signal is significant and particularly manifests at intermediate and high-momentum transfers. Strikingly, for molecules with inversion symmetry, the exclusion of bound or continuum transitions may lead to the prediction of spurious coherent-mixed signals. We conclude that qualitative and quantitative accuracies of predicted scattering signals on detectors without energy resolution require that elements of the two-electron density operator are used. This approach inherently accounts for all accessible electronic transitions, including ionization.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2015

The metagalactic ionizing background: A crisis in UV photon production or incorrect galaxy escape fractions?

Recent suggestions of a “photon underproduction crisis” have generated concern over the intensity and spectrum of ionizing photons in the metagalactic ultraviolet background (UVB). The balance of hydrogen photoionization and recombination determines the opacity of the low-redshift intergalactic medium (IGM). We calibrate the hydrogen photoionization rate (Γ{sub H}) by comparing Hubble Space Telescope spectroscopic surveys of the low-redshift column density distribution of H i absorbers and the observed (z<0.4) mean Lyα flux decrement, D{sub A}=(0.014)(1+z){sup 2.2}, to new cosmological simulations. The distribution, f(N{sub H I},z)≡d{sup 2}N/d(logN{sub H I})dz, is consistent with an increased UVB that includes contributions from both quasars and galaxies. Our recommended fit, Γ{sub H}(z)=(4.6×10{sup −14} s{sup −1})(1+z){sup 4.4} for 0<z<0.47, corresponds to unidirectional LyC photon flux Φ{sub 0}≈5700 cm{sup −2} s{sup −1} at z = 0. This flux agrees with observed IGM metal ionization ratios (C iii/C iv and Si iii/Si iv) and suggests a 25%–30% contribution of Lyα absorbers to the cosmic baryon inventory. The primary uncertainties in the low-redshift UVB are the contribution from massive stars in galaxies and the LyC escape fraction (f{sub esc}), a highly directional quantity that is difficult to constrain statistically. We suggest that both quasars and low-mass starburst galaxies are important contributors to the ionizing UVB at z<2. Their additional ionizing flux would resolve any crisis in photon underproduction.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2016

High efficiency resonance ionization of palladium with Ti:sapphire lasers

Here, we present the development and testing of highly efficient excitation schemes for resonance ionization of palladium. To achieve the highest ionization efficiencies, a high-power, high repetition rate Ti:sapphire laser system was used and 2-step, 3-step and 4-step schemes were investigated and compared. Starting from different excited steps, the frequencies of the final ionization steps were tuned across the full accessible spectral range of the laser system, revealing several autoionizing Rydberg series, which converge towards the energetically higher lying state 4d 9 2 D 3/2 of the Pd + ion ground state configuration. Through proper choice of these excitation steps, we developed a highly efficient, fully resonant 3-step excitation scheme, which lead to overall efficiencies of 54.3(1.4)% and 59.7(2.1)%, measured at two independent mass separator setups. Lastly, to our knowledge, these are presently the highest efficiency values ever achieved with a resonance ionization laser ion source.

74 ATOMIC AND MOLECULAR PHYSICS↗
DOE OSTI2018

Near threshold electron-impact double ionization of helium

We examine the break-up pattern for the electron-impact double ionization of helium using a time-dependent close-coupling approach. This ionization process is one of the simplest examples of the Coulomb four-body problem of three charged particles moving in the Coulomb field of a bare nucleus. Studies of this four-body process in the near-threshold region allow exploration of the break-up dynamics, which have been stimulated by differing predictions of the most likely geometries for break-up in the related processes of triple photoionization of lithium and electron-impact double ionization of helium. While both processes lead to the same final state of three electrons moving in the field of a bare nucleus, the preferred break-up pattern at low energies for the triple photoionization is predicted as a T-shape (Emmanouilidou et al 2008 Phys. Rev. Lett. 100 063002; Colgan et al 2013 Phys. Rev. Lett. 110 063001) and for the electron-impact double ionization as a 'triangle' pattern (Ren et al 2008 Phys. Rev. Lett. 101 093201). Our calculations at an excess energy of 5 eV show that a triangle break-up pattern is favored, confirming earlier experimental results (Ren et al 2008 Phys. Rev. Lett. 101 093201).

Optics↗
DOE OSTI2021

Near-surface modification of defective KTaO 3 by ionizing ion irradiation

The synergistic effect of nuclear (S n ) and electronic (S e ) energy loss observed in some ABO 3 perovskites has attracted considerable attention due to the real possibility to modify various near-surface properties, such as the electronic and optical properties, by patterning ion tracks in the defective near-surface regions. In this study, we show that low-energy ion-induced disordering in conjunction with ionizing ion irradiation (18 MeV Si, 21 MeV Ni and 91.6 MeV Xe) is a promising approach for tailoring ion tracks in the near-surface of defective KTaO 3 . Experimental characterization and computer simulations reveal that the size of these latent ion tracks increases with S e and level of pre-existing damage. These results further reveal that the threshold S e value (S e th ) for track creation increases with decreasing pre-damage level. The values of S e th increase from 5.02 keV nm -1 , for a pre-existing fractional disorder of 0.53 in KTaO 3 , to 10.81 keV nm -1 for pristine KTaO 3 . Above these thresholds, amorphous latent tracks are produced due local melting and rapid quenching. Below a disorder fraction of 0.08 and S e ≤ 6.68 keV nm -1 , the synergistic effect is not active, and damage accumulation is suppressed due to a competing ionization-induced damage annealing process. These results indicate that, depending on S e and the amount of pre-existing damage, highly ionizing ions can either enhance or suppress damage accumulation in KTaO 3 , thus providing a pathway to tailoring defects states. Comprehending the conflicting roles of highly ionizing ions in defective ABO 3 oxides is vital for understanding and predictive modeling of ion-solid interactions in complex oxides, as well as for achieving control over ion track size in the near-surface of defective KTaO 3 .

36 MATERIALS SCIENCE↗
DOE OSTI2022

Studies of EC pre-ionization in DIII-D to support development of ITER plasma initiation

New experiments have been conducted at DIII-D to improve the physics understanding of plasma initiation assisted by electron cyclotron (EC) wave injection, allowing better extrapolation to ITER. This has been achieved by applying an EC pulse prior to start of the inductive plasma initiation (i.e. the generation of a loop voltage). A pre-plasma was formed during the EC pulse that was characterized in terms of the maximum density and temperature. Parametric scans were performed to study the influence of the EC injected power, EC injection angle, and pre-fill gas pressure on the pre-plasma creation process. These experiments showed that pre-ionized plasma of good quality can have a significant effect on the subsequent V loop induced plasma initiation process, i.e. a high density pre-plasma, increases the plasma current rise and speed at which ionization is achieved when the V loop is applied. Here, a good quality pre-plasma is one that achieved a significant degree of ionization, mainly obtained by providing sufficient ECH power in DIII-D of the order of 1 MW. It was found that a minimum EC power of 0.5 MW was required in DIII-D to create ionization, and this would scale to a minimum power of roughly 6.5 MW for ITER.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2025

Estimating ionization states and continuum lowering from ab initio path integral Monte Carlo simulations for warm dense hydrogen

Warm dense matter (WDM) is an active field of research, with applications ranging from astrophysics to inertial confinement fusion. Ionization degree and continuum lowering are important quantities to understand how materials behave under these conditions, but can be difficult to diagnose since experimental campaigns are limited and often require model-dependent analysis. This is especially true for hydrogen, which has a comparably low scattering cross section, making high-quality data particularly difficult to obtain. Consequently, building equation of state tables often relies on simulations in combination with untested approximations to extract properties from experiments. Here, we investigate an approach for extracting the ionization potential depression and ionization degree—quantities which are otherwise not directly accessible from the physical model—from first-principles path integral Monte Carlo (PIMC) simulations utilizing a chemical model. In contrast to experimental measurements, where noise and nonequilibrium effects add to the uncertainty of the inferred parameters, PIMC simulations provide a clean signal with well-defined thermodynamic conditions. Comparisons against commonly used models show a qualitative agreement, but we find deviations primarily for the high-density and high-temperature cases. We also demonstrate the decreasing sensitivity of the dynamic structure factor with respect to both ionization and continuum lowering for increasing scattering angles in x-ray Thomson scattering experiments. Our work has important implications for the design of future experiments, but also offers qualitative understanding of structure factors and the imaginary-time correlation function obtained from first-principles quantum Monte Carlo simulations.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2019

Direct laser ion acceleration and above-threshold ionization at intensities from 10 21 W/cm 2 to 3 × 10 23 W/cm 2

Calculations on the dynamics of ions and electrons in near-infrared laser fields at intensities up to 3 × 10 23 W/cm 2 are presented here. We explore the acceleration of ions in a laser focus by conservation of canonical momentum during ionization events and by the ponderomotive force in the f/1 focal geometry required to reach such intensity. At intensities exceeding 10 23 W/cm 2 , highly charged ions are expelled from the laser focus before they can interact with the laser pulse at peak intensity, decreasing the predicted ionization yields of deeply bound states. We consider the interaction of a tightly focused, f/1 laser pulse with krypton at an intensity of 3 × 10 23 W /cm 2 and a pulse duration of 140 fs.We find that the ions and electrons are accelerated to energies in excess of 2 MeV/nucleon and 1.4 GeV, respectively. Ponderomotive expulsion of the parent ions decreases the total number of ultrarelativistic above-threshold ionization electrons produced by tunneling ionization from the K-shell states of krypton but does not change their energy spectrum.

74 ATOMIC AND MOLECULAR PHYSICS↗
DOE OSTI2020

Angle-dependent strong-field ionization and fragmentation of carbon dioxide measured using rotational wave packets

In this work, we experimentally study the angle-dependent single ionization of carbon dioxide (CO 2 ) by linearly and circularly polarized pulses. The angle dependence of the ionization probability by linearly polarized pulses extracted from time-domain measurements on an impulsively excited rotational wave packet is compared with data obtained from a direct angle-scan measurement. The results from the measurement with linear and circular polarization are consistent with the adiabatic ionization approximation. Further, we extend the time-domain method to extract the dependence of the asymptotic momentum distribution of fragment ions on the orientation of the molecular axis, and apply it to investigate dissociative double ionization of CO 2 . We show that such measurements can directly test the validity of the axial recoil approximation.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2021

Strong-field ionization of water: Nuclear dynamics revealed by varying the pulse duration

Polyatomic molecules in strong laser fields can undergo substantial nuclear motion within tens of femtoseconds. Ion imaging methods based on dissociation or Coulomb explosion therefore have difficulty faithfully recording the geometry dependence of the field ionization that initiates the dissociation process. Here we compare the strong-field double ionization and subsequent dissociation of water (both H 2 O and D 2 O) in 10-fs and 40-fs 800-nm laser pulses. We find that 10-fs pulses turn off before substantial internuclear motion occurs, whereas rapid internuclear motion can take place during the double ionization process for 40-fs pulses. The short-pulse measurements are consistent with a simple tunnel ionization picture whose predictions help interpret the motion observed in the long-pulse measurements.

74 ATOMIC AND MOLECULAR PHYSICS↗
DOE OSTI2015

Strong-field ionization with two-color circularly polarized laser fields

Strong-field ionization provides fundamental insight into light-matter interactions, encoding the structure of atoms and molecules on the subångström and subfemtosecond scales. Here, we explore an important regime: strong-field ionization by two-color circularly polarized laser fields. In contrast to past work using linearly polarized drivers, we probe electron trajectories that are driven in a two-dimensional plane, thus separating the tunneling angle from the rescattering angle. This allows us to make several findings. First, we observe a single-lobed electron distribution for co-rotating fields, and a three-lobed distribution for counter-rotating fields, providing experimental validation of the theoretical model explaining the generation of circularly polarized high harmonic light. Second, we discover that there is significant electron-ion rescattering using counter-rotating fields, but not with co-rotating fields. Finally, we show that the rescattered electrons are well separated from the directly ionized electrons, in striking contrast to similar low-energy structures seen with linearly polarized fields. These findings help overcome the long-standing problem of how to decouple the tunneling and rescattering steps in strong-field ionization, which will enable new dynamic probes of atomic and molecular structure.

74 ATOMIC AND MOLECULAR PHYSICS↗
DOE OSTI2015

Measurement of Scintillation and Ionization Yield and Scintillation Pulse Shape from Nuclear Recoils in Liquid Argon

We have measured the scintillation and ionization yield of recoiling nuclei in liquid argon as a function of applied electric field by exposing a dual-phase liquid argon time projection chamber (LAr-TPC) to a low energy pulsed narrow band neutron beam produced at the Notre Dame Institute for Structure and Nuclear Astrophysics. Liquid scintillation counters were arranged to detect and identify neutrons scattered in the TPC and to select the energy of the recoiling nuclei. We also report measurements of the scintillation yields for nuclear recoils with energies from 10.3 to 57.3 keV and for median applied electric fields from 0 to 970 V/cm. For the ionization yields, we report measurements from 16.9 to 57.3 keV and for electric fields from 96.4 to 486 V/cm. Furthermore, we report the observation of an anticorrelation between scintillation and ionization from nuclear recoils, which is similar to the anticorrelation between scintillation and ionization from electron recoils. Assuming that the energy loss partitions into excitons and ion pairs from 83m Kr internal conversion electrons is comparable to that from 207 Bi conversion electrons, we obtained the numbers of excitons (N ex ) and ion pairs (N i ) and their ratio (N ex /N i ) produced by nuclear recoils from 16.9 to 57.3 keV. Motivated by arguments suggesting direction sensitivity in LAr-TPC signals due to columnar recombination, a comparison of the light and charge yield of recoils parallel and perpendicular to the applied electric field is presented for the first time.

46 INSTRUMENTATION RELATED TO NUCLEAR SCIENCE AND ↗
DOE OSTI2024

Numerical investigation of nonequilibrium electron effects on the collisional ionization rate in the collisional-radiative model

In this study, the interplay of kinetic electron physics and atomic processes in ultrashort laser-plasma interactions provides a comprehensive understanding of the impact of the electron energy distribution on plasma properties. Notably, nonequilibrium electrons play a vital role in collisional ionization, influencing ionization degrees and spectra. This paper introduces a computational model that integrates the physics of kinetic electrons and atomic processes, utilizing a Boltzmann equation for nonequilibrium electrons and a collisional-radiative model for atomic state populations. The model is used to investigate the influence of nonequilibrium electrons on collisional ionization rates and its effect on the population distribution, as observed in a widely known experiment. The study reveals a significant nonequilibrium electron presence during XFEL-matter interactions, profoundly affecting collisional ionization rates in the gas plasma, thereby necessitating careful consideration of the Collisional-Radiative model applied to such systems.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2016

Compressing turbulence and sudden viscous dissipation with compression-dependent ionization state

Turbulent plasma flow, amplified by rapid three-dimensional compression, can be suddenly dissipated under continuing compression. Furthermore, this effect relies on the sensitivity of the plasma viscosity to the temperature, μ ~ T 5 / 2 . The plasma viscosity is also sensitive to the plasma ionization state. Here, we show that the sudden dissipation phenomenon may be prevented when the plasma ionization state increases during compression, and we demonstrate the regime of net viscosity dependence on compression where sudden dissipation is guaranteed. In addition, it is shown that, compared to cases with no ionization, ionization during compression is associated with larger increases in turbulent energy and can make the difference between growing and decreasing turbulent energy.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2019

Ionization potential depression and Pauli blocking in degenerate plasmas at extreme densities

New facilities explore warm dense matter (WDM) at conditions with extreme densities (exceeding ten times condensed matter densities) so that electrons are degenerate even at temperatures of 10 - 100 eV. Whereas in the non-degenerate region correlation effects such as Debye screening are relevant for the ionization potential depression (IPD), new effects have to be considered in degenerate plasmas. In addition to the Fock shift of the self-energies, the bound-state Pauli blocking becomes important with increasing density. Standard approaches to IPD such as Stewart-Pyatt and widely used opacity tables (e.g., OPAL) do not contain Pauli blocking effects for bound states. The consideration of degeneracy effects leads to a reduction of the ionization potential and to a higher degree of ionization. As an example, we present calculations for the ionization degree of carbon plasmas at T = 100 eV and extreme densities up to 40 g/cm 3 , which are relevant to experiments that are currently scheduled at the National Ignition Facility.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2025

Isotope-selective strong-field ionization of semiheavy water

Semiheavy water (HOD) is one of the simplest molecules in which the bonds are labeled by isotope. We demonstrate that a pair of intense few-femtosecond infrared laser pulses can be used to selectively tunnel ionize along one of the two bonds. The first pulse doubly ionizes HOD, inducing rapid bond stretching and unbending. Femtoseconds later, the second pulse arrives and further ionization is selectively enhanced along the OH bond. These conclusions arise from 3D time-resolved measurements of H + , D + , and O + momenta following triple ionization. Published by the American Physical Society 2025

Howard, A. J. (ORCID:0000000303033222)↗
DOE OSTI2022

Measurements of the ionization efficiency of protons in methane

The amount of energy released by a nuclear recoil ionizing the atoms of the active volume of detection appears “quenched” compared to an electron of the same kinetic energy. This different behavior in ionization between electrons and nuclei is described by the Ionization Quenching Factor (IQF) and it plays a crucial role in direct dark matter searches. For low kinetic energies (below 50 keV ), IQF measurements deviate significantly from common models used for theoretical predictions and simulations. We report measurements of the IQF for proton, an appropriate target for searches of Dark Matter candidates with a mass of approximately 1 GeV , with kinetic energies in between 2 keV and 13 keV in 100 mbar of methane. We used the Comimac facility in order to produce the motion of nuclei and electrons of controlled kinetic energy in the active volume, and a NEWS-G SPC to measure the deposited energy. The Comimac electrons are used as a reference to calibrate the detector with 7 energy points. A detailed study of systematic effects led to the final results well fitted by IQF (E K )=E$^α_K$ / (β+E$^α_K$) with α=0.70±0.08 and β=1.32±0.17 . In agreement with some previous works in other gas mixtures, we measured less ionization energy than predicted from SRIM simulations, the difference reaching 33% at 2 keV .

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2021

Higher-order harmonic generation and strong field ionization with Bessel–Gauss beams in a thin jet geometry

A promising alternative to Gaussian beams for use in strong field science is Bessel–Gauss (BG or Bessel-like) laser beams, as they are easily produced with readily available optics and provide more flexibility of the spot size and working distances. Here we use BG beams produced with a lens-axicon optical system for higher-order harmonic generation (HHG) in a thin gas jet. The finite size of the interaction region allows for scans of the HHG yield along the propagation axis. Further, by measuring the ionization yield in unison with the extreme ultraviolet (XUV), we are able to distinguish regions of maximum ionization from regions of optimum XUV generation. This distinction is of great importance for BG fields, as the generation of BG beams with axicons often leads to oscillations of the on-axis intensity, which can be exploited for extended phase-matching conditions. We observed such oscillations in the ionization and XUV flux along the propagation axis for the first time. As is the case for Gaussian modes, the harmonic yield is not maximum at the point of highest ionization. Finally, despite Bessel beams having a hole in the center in the far field, the XUV beam is well collimated, making BG modes a great alternative when spatial filtering of the fundamental is desired.

Davino, Michael↗