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At least 145 records · Page 8
All sourcesNASA NTRSDOE OSTI
NASA NTRS2011

Positronium and Electron Scattering on Helium

A recent work [1] establishes experimentally that Positronium scattering by atoms of various elements is surprisingly close in total cross-section to that of an isolated electron of the same velocity. In this work we will look at the scattering of Ps on Helium and compare it to a determination of the scattering of an e- with the same element. For both the Ps scattering and the e- scattering on He, we assume the symmetrization of the e- with the closed shell He electrons is the dominant interaction. A local effective potential employed in [2] and [3] is used to model the electron exchange and cross- sections are determined for a set of partial waves. For the Ps scattering we include as a secondary effect the Van der Waals interaction. For single e- scattering of He, we also employ a short range Coulomb potential and dispersion as contributing effects. Results of the cross-sections determined in each case are then compared

DiRienzi, Joseph↗
NASA NTRS2002

D-Wave Resonances in Positronium Hydride

The problem of calculating the position and width of the lowest-lying (L = 0, 1) resonances in the Ps + H scattering system has recently been re-examined by the authors [1]. In the model used, resonances axe assumed generated by bound Rydberg states in the closed re-arranged channel [e(+) + H(-)]. This infinite series of Coulomb bound states are shifted somewhat by the coupling with the open scattering channel [Ps + H]. Estimates using this approach, first carried out by one of the authors [2] using a simple form of scattering wavefunction, indicated an anticipated small shift of resonance away from the Rydberg energy in the S-wave (L = 0). More recent results by Ho and Yan [3] using the complex-rotation method showed unexpected significant shifting in the P (L = 1) and D (L = 2)-wave resonance energies from their respective unperturbed values. Our re-calculation of the resonances [I I for L = 0 and I indicates that, in each case, reasonably consistent resonance energies are obtained by coupling the two lowest lying states (IS and 2S for L = 0 and 2P and 3P for L = 1). For each L it is the higher state (2S and 3P, respectively) that produces the resonance. The lower state (1S and 2P, respectively) is effective only in increasing the non-resonant phase shift. In this work we extend the model to L = 2 (D-waves). Our results show that, unlike the S and P-waves, the 313-state alone produces a resonant energy that is very close to the result of Yan and Ho [3]. Inclusion of the 4D-state produces a second resonance in the scattering system shifted up slightly from its unperturbed Rydberg energy.

Drachman, Richard J.↗
DOE OSTI2026

Observing the effects of numbers of valence nucleons on 0$^{+}_{𝑔⁡𝑠}$ → 2$^{+}_{1}$ transitions in deformed nuclei by comparing proton and neutron transition matrix elements

We examined the ratios of neutron and proton transition matrix elements, 𝑀 𝑛 /𝑀 𝑝 , for the 0$^{+}_{𝑔⁡𝑠}$ → 2$^{+}_{1}$ transitions in 48 even-even stable nuclei with 𝑁 > 20 for which electromagnetic matrix elements were compiled by Pritychenko et al. and for which high-quality inelastic proton-scattering data were available. Several deformed rare-earth nuclei have (𝑀 𝑛 /𝑀 𝑝 )/(𝑁/𝑍) values significantly below 1.0, which is not consistent with a simple liquid-drop picture. However, this phenomenon can be explained using a schematic picture in which 𝑀 𝑝 reaches a maximum at proton midshell (𝑍 = 66) and 𝑀𝑛 reaches its maximum at neutron midshell (𝑁 = 104). Several midmass vibrational nuclei have 𝑀 𝑛 /𝑀 𝑝 values significantly below 𝑁/𝑍, which is not consistent with the expectation that 𝑀 𝑛 /𝑀 𝑝 = 𝑁/𝑍 in such nuclei. As a result, a shell-model investigation of these observations might yield insights about this behavior.

Collective levels↗
DOE OSTI2021

Quantum simulation of nuclear inelastic scattering

We present a time-dependent quantum algorithm for nuclear inelastic scattering in the time-dependent basis function on qubits approach. This algorithm aims to quantum simulate a subset of the nuclear inelastic scattering problems that are of physical interest in which the internal degrees of freedom of the reaction system are excited by time-dependent external interactions. We expect that our algorithm will enable an exponential speedup in simulating the dynamics of the subset of the inelastic scattering problems, which would also be advantageous for the applications to more complicated scattering problems. For a demonstration problem, we solve for the Coulomb excitation of the deuteron, where the quantum simulations are performed with IBM Qiskit.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2020

Static and dynamic spin properties in the quantum triangular lattice antiferromagnet Ag 2 CoO 2

In Ag 2 CoO 2 , Co forms triangular lattice layers, which are separated by the metallic (Ag 2 ) block. The magnetic susceptibility and heat capacity measurements show that this material exhibits an antiferromagnetic transition at T N =17.5 K and the Weiss temperature (T Θ ) and the effective moment are -274 K and 1.62μ B , respectively, indicating that the Co ion carries spin (S) 1/2 and has a strongly frustrated state with T Θ /T N =15.7. A density functional theory calculation confirmed that the valence state of the Co ions is 2+ and the low-spin state with S=1/2 is realized at reduced on-site Coulomb interaction on Co. We performed elastic and inelastic neutron scattering experiments in a powder sample of Ag 2 CoO 2 . Although no noticeable magnetic Bragg peaks were observed below T N , distinct magnetic excitations were observed in the inelastic neutron scattering experiments. The excitations are consistent with those expected for the S=1/2 Heisenberg triangular lattice antiferromagnet. These results suggest that the ordered moment is reduced due to the quantum effect, which explains the absence of the magnetic Bragg peaks. Our results thus suggest that Ag 2 CoO 2 is a good candidate to realize a quantum Heisenberg triangular lattice antiferromagnet.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2020

Negligible voltage hysteresis with strong anionic redox in conventional battery electrode

Lattice anionic (oxygen) redox reactions (ARR) offers opportunities for developing high-capacity batteries, however, often suffers the notoriously high hysteresis in voltages and low initial coulombic efficiency. Particularly, ARR was widely considered inherent to these kinetic issues. Here, unambiguous evidences of strong and reversible ARR is found in Na 2/3 Ni 1/3 Mn 2/3 O 2 through mapping of resonant inelastic X-ray scattering (mRIXS). Strikingly, the material displays negligible voltage hysteresis (0.1 V) and high initial coulombic efficiency with a highly stable electrochemical profile. Our independent analysis of the Ni, Mn and O states consistently interpret the redox mechanism of Na 2/3 Ni 1/3 Mn 2/3 O 2 , which reveals a strong ARR system with facile kinetics and highly stable electrochemical profile that previously found only in cationic redox systems of conventional non-Alkali-rich materials.

25 ENERGY STORAGE↗
DOE OSTI2023

Background optimization of powder electron diffraction for implementation of the e-PDF technique and study of the local structure of iron oxide nanocrystals

The local structural characterization of iron oxide nanoparticles is explored using a total scattering analysis method known as pair distribution function (PDF) (also known as reduced density function) analysis. The PDF profiles are derived from background-corrected powder electron diffraction patterns (the e-PDF technique). Due to the strong Coulombic interaction between the electron beam and the sample, electron diffraction generally leads to multiple scattering, causing redistribution of intensities towards higher scattering angles and an increased background in the diffraction profile. In addition to this, the electron–specimen interaction gives rise to an undesirable inelastic scattering signal that contributes primarily to the background. The present work demonstrates the efficacy of a pre-treatment of the underlying complex background function, which is a combination of both incoherent multiple and inelastic scatterings that cannot be identical for different electron beam energies. Therefore, two different background subtraction approaches are proposed for the electron diffraction patterns acquired at 80 kV and 300 kV beam energies. From the least-square refinement (small-box modelling), both approaches are found to be very promising, leading to a successful implementation of the e-PDF technique to study the local structure of the considered nanomaterial.

36 MATERIALS SCIENCE↗
NASA NTRS2001

Resonances in Positronium Hydride

Recently, Ho and his colleagues have calculated the positions and widths of a series of resonances in the Ps+H scattering system, using the complex -rotation method and have compared them with estimates that I made many years ago using a quite different technique. I assumed that the resonance mechanism was the existence in the rearrangement channel [e+ + H-] of an infinite series of perturbed Coulomb bound states. Although these must be broadened and shifted by coupling with the open scattering channel, I expected them to lie very close to the actual resonance positions. To verify this, I did a model calculation for S-waves, including the coupling, and found that the first two resonances were not shifted very far from their unperturbed position. The new, detailed calculation agrees with this result, but when the P-wave was examined it was found, surprisingly, that the lowest resonance indeed moved up in energy by a large amount. With the help of Joseph DiRienzi of the College of Notre Dame of Maryland I am now extending the old calculation to P- and D-waves, in an attempt to understand this unexpected energy shift. Results will be presented at the Workshop.

Drachman, Richard J.↗
DOE OSTI2024

Coulomb Branch Amplitudes from a Deformed Amplituhedron Geometry

The amplituhedron provides, via geometric means, the all-loop integrand of scattering amplitudes in maximally supersymmetric Yang-Mills theory. Unfortunately, dimensional regularization, used conventionally for integration, breaks the beautiful geometric picture. This motivates us to propose a “deformed” amplituhedron. Focusing on the four-particle amplitude, we introduce two deformation parameters, which can be interpreted as particle masses. We provide evidence that the mass pattern corresponds to a specific choice of vacuum expectation values on the Coulomb branch. The deformed amplitude is infrared finite, making the answer well defined in four dimensions. Leveraging four-dimensional integration techniques based on differential equations, we compute the amplitude up to two loops. In the limit where the deformation parameters are taken to zero, we recover the known Bern-Dixon-Smirnov amplitude. In the limit where only one deformation parameter is taken to zero, we find a connection to the angle-dependent cusp anomalous dimension. Published by the American Physical Society 2024

Physics↗
NASA NTRS1992

Collision integrals for the interaction of the ions of nitrogen and oxygen in a plasma at high temperatures and pressures

The corrections to the transport cross-sections and collision integrals for Coulomb interactions arising from the application of realistic interaction energies of the ions of nitrogen and oxygen are investigated. Accurate potential-energy curves from an ab initio electronic-structure calculation and a semiclassical description of the scattering are used to determine the difference between the cross-sections for the real interaction forces and a Coulomb force for large values of the Debye shielding parameter. Graphs of the correction to the diffusion and viscosity-collision integrals are presented for temperatures from about 10,000 K to 150,000 K. This correction can be combined with tabulations of the collision integrals for shielded Coulomb potentials to determine the contribution of N(+)-N(+), N(+)-O(+), and O(+)-O(+) interactions to the transport properties of high-temperature air. Analytical forms are fitted to the calculated results to assist this application.

Stallcop, James R.↗
NASA NTRS2002

Transport of Photoelectrons in the Nightside Magnetosphere

Kinetic modeling results are analyzed to examine the transport of photoelectrons through the nightside inner magnetosphere. Two sources are considered, those on the dayside from direct solar illumination and those across the nightside from light scattered by the upper atmosphere and geocorona. A natural filter exists on the nightside for the dayside photoelectrons. Coulomb collisions erode the distribution at low energies and low L shells, and magnetospheric convection compresses the electrons as they drift toward dawn. It is shown that for low-activity levels a band of photoelectrons forms between L = 4 and 6 that extends throughout the nightside local times and into the morning sector. For the scattered light photoelectrons the trapped zone throughout the nightside is populated with electrons of E less than 30 eV. At high L shells near dawn, convective compression on the nightside yields an accelerated population with electrons at energies up to twice the ionospheric energy maximum (that is, roughly 1200 eV for dayside photoelectrons and 60 eV for scattered light electrons). Modeled energy and pitch angle distributions are presented to show the features of these populations.

Khazanov, G. V.↗
DOE OSTI2020

Nonlocal correlations in iron pnictides and chalcogenides

Deviations of low-energy electronic structurse of iron-based superconductors from density-functional-theory predictions have been parametrized in terms of band- and orbital-dependent mass renormalizations and energy shifts. The former have typically been described in terms of a local self-energy within the framework of dynamical mean field theory, while the latter appears to require nonlocal effects due to interband scattering. By calculating the renormalized band structure in both random phase approximation (RPA) and the two-particle self-consistent approximation (TPSC), we show that correlations in pnictide systems like LaFeAsO and LiFeAs can be described rather well by a nonlocal self-energy. In particular, Fermi pocket shrinkage as seen in experiments occurs due to repulsive interband finite-energy scattering. For the canonical iron chalcogenide system FeSe in its bulk tetragonal phase, the situation is, however, more complex since even including momentum-dependent band renormalizations cannot explain experimental findings. We propose that the nearest-neighbor Coulomb interaction may play an important role in band-structure renormalization in FeSe. Finally, we further compare our evaluations of nonlocal quasiparticle scattering lifetime within RPA and TPSC with experimental data for LiFeAs.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
NASA NTRS2001

Transport of Photoelectrons in the Nightside Magnetosphere

Kinetic modeling results are analyzed to examine the transport of photoelectrons through the nightside inner magnetosphere. Two sources are considered, those on the dayside from direct solar illumination, and those at all local times from light scattered by the upper atmosphere and geocorona. For the dayside photoelectrons, a natural filter exists oil the nightside for these particles, with Coulomb collisions eroding the distribution at low energies and low L shells, and magnetospheric convection compressing the flux tubes as they corotate towards dawn. It is shown that, for low activity levels, a band of photoelectrons forms between L=4 and 6 that extends throughout the nightside local times and into the morning sector. For the scattered light photoelectrons, the trapped zone throughout the nightside is filled for energies less than 30 eV. Convective compression on the nightside and expansion on the dayside yields an accelerated population up to 50 eV at high L shells around dawn. Modeled energy and pitch angle distributions are presented to show the development and features of these populations. Such distinctive features should be observable in satellite spectrometer measurements.

Khazanov, G. V.↗
DOE OSTI2024

Studying the interaction between charm and light-flavor mesons

The two-particle momentum correlation functions between charm mesons ( D * ± and D ± ) and charged light-flavor mesons ( π ± and K ± ) in all charge combinations are measured for the first time by the ALICE Collaboration in high-multiplicity proton–proton collisions at a center-of-mass energy of s = 13 TeV . For DK and D * K pairs, the experimental results are in agreement with theoretical predictions of the residual strong interaction based on quantum chromodynamics calculations on the lattice and chiral effective field theory. In the case of D π and D * π pairs, tension between the calculations including strong interactions and the measurement is observed. For all particle pairs, the data can be adequately described by Coulomb interaction only, indicating a shallow interaction between charm and light-flavor mesons. Finally, the scattering lengths governing the residual strong interaction of the D π and D * π systems are determined by fitting the experimental correlation functions with a model that employs a Gaussian potential. The extracted values are small and compatible with zero. © 2024 CERN, for the ALICE Collaboration 2024 CERN

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2020

Comparison of optical potential for nucleons and $\varDelta $ resonances

Precise modeling of neutrino interactions on nuclear targets is essential for neutrino oscillations experiments. The modeling of the energy of final state particles in quasielastic (QE) scattering and resonance production on bound nucleons requires knowledge of both the removal energy of the initial state bound nucleon as well as the average Coulomb and nuclear optical potentials for final state leptons and hadrons. We extract the average values of the real part of the nuclear optical potential for final state nucleons ( $U_{opt}^{QE}$ U opt QE ) as a function of the nucleon kinetic energy from inclusive electron scattering data on nuclear targets ( $_\mathbf{6 }^\mathbf{12 }{} \mathbf{C} $ 6 12 C + $_\mathbf{8 }^\mathbf{16 }{} \mathbf{O} $ 8 16 O , $_\mathbf{20 }^\mathbf{40 }{} \mathbf{Ca} $ 20 40 Ca + $_\mathbf{18 }^\mathbf{40 }{} \mathbf{Ar} $ 18 40 Ar , $_\mathbf{3 }^\mathbf{6 }{} \mathbf{Li} $ 3 6 Li , $_\mathbf{18 }^\mathbf{27 }{} \mathbf{Al} $ 18 27 Al , $_\mathbf{26 }^\mathbf{56 }{} \mathbf{Fe} $ 26 56 Fe , $_\mathbf{82 }^\mathbf{208 }{} \mathbf{Pb} $ 82 208 Pb ) in the QE region and compare to calculations. We also extract values of the average of the real part of the nuclear optical potential for a $\varDelta (1232)$ Δ ( 1232 ) resonance in the final state ( $U^\varDelta _{opt}$ U opt Δ ) within the impulse approximation. We find that $U^\varDelta _{opt}$ U opt Δ is more negative than $U_{opt}^{QE}$ U opt QE with $U^\varDelta _{opt}\approx $ U opt Δ ≈ 1.5 $U_{opt}^{QE}$ U opt QE for $_\mathbf{6 }^\mathbf{12 }{} \mathbf{C} $ 6 12 C .

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2023

Precise ${dd}$ excitations and commensurate intersite Coulomb interactions in the dissimilar cuprates YBa 2 Cu 3 O 7–y and La 2–x Sr x CuO 4

Using high-resolution extreme ultraviolet resonant inelastic X-ray scattering (EUVRIXS) spectroscopy at Cu M-edge, we observed the doping dependent spectral shifts of inter-orbital (${dd}$) excitations of YBa 2 Cu 3 O 7-y and La 2-x Sr x CuO 4 . With increasing hole doping level from undoped to optimally doped superconducting compositions, the leading edge of ${dd}$ excitations is found to shift towards lower energy loss in a roughly linear trend that is irrespective to the cuprate species. The magnitude of energy shift can be explained by including a 0.15 eV Coulomb attraction between Cu 3d(x 2 -y 2 ) electrons and the doped holes on the surrounding oxygens in the atomic multiplet calculations. Finally, the consistent energy shift between distinct cuprate families suggests that this inter-site Coulomb interaction energy scale is relatively material-independent, and provides an important reference point for understanding charge density wave phenomena in the cuprate phase diagram.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
NASA NTRS1994

A Coulomb collision algorithm for weighted particle simulations

A binary Coulomb collision algorithm is developed for weighted particle simulations employing Monte Carlo techniques. Charged particles within a given spatial grid cell are pair-wise scattered, explicitly conserving momentum and implicitly conserving energy. A similar algorithm developed by Takizuka and Abe (1977) conserves momentum and energy provided the particles are unweighted (each particle representing equal fractions of the total particle density). If applied as is to simulations incorporating weighted particles, the plasma temperatures equilibrate to an incorrect temperature, as compared to theory. Using the appropriate pairing statistics, a Coulomb collision algorithm is developed for weighted particles. The algorithm conserves energy and momentum and produces the appropriate relaxation time scales as compared to theoretical predictions. Such an algorithm is necessary for future work studying self-consistent multi-species kinetic transport.

Miller, Ronald H.↗