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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 145 records · Page 8
All sourcesNASA NTRSDOE OSTI
NASA NTRS1989

Detection of elliptical polarization and mode splitting in discrete Schumann resonance excitations

Elliptical polarization and mode splitting have been detected in the magnetic component of discrete, well defined Schumann resonance excitations. These ELF excitations, which are large electromagnetic transients of approximately 1 s duration, are called Q-bursts and typically occur every few minutes. They are believed to be the signature of the impulsive excitation of the earth-ionosphere cavity by ultra-large lightning currents. In this paper the magnetic polarization and spectral characteristics of four large Q-bursts are examined in detail using a new analysis technique. Two events display right-hand polarization and two display left-hand polarization. The theoretical polarization properties of the central and side multiplets of the Schumann resonances are used to define a local orthogonal coordinate system in the measurement frame in which these components may be separated. Maximum entropy spectrums computed separately for what are identified to be the central and side multiplets in this coordinate system show distinctly different eigenfrequencies for the lowest mode near 7.5 Hz. For the limited number of cases examined the magnitude of the line splitting detected using this technique is roughly 1.4-1.8 Hz, larger by nearly a factor of two than theoretical or observed values of the splitting previously reported. The frequencies of the side multiplets may lie either above or below the frequency of the central multiplet.

Sentman, D. D.↗
NASA NTRS1996

Fast Nitrogen Atoms from Dissociative Excitation of N2 by Electron Impact

The Doppler profiles of one of the fine structure lines of the N I (1200 A) g (sup 4)S(sup 0)-(sup 4)P multiplet and of the N II (1085 A) g (sup 3)p(sup O)-(sup 3)D multiplet have been measured. Excitation of the multiplets is produced by electron impact dissociative excitation of N2. The experimental line profiles are evaluated by fast Fourier transform (FFT) techniques and analysis of the profiles yields the kinetic energy distribution of fragments. The full width at half maximum (FWHM) of N I (1200 A) increases from 27+/-6 mA at 30 eV to 37+/-4 mA at 100 eV as the emission cross section of the dissociative ionization excitation process becomes more important relative to the dissociative excitation process. The FWHM of the N II (1085 A) line is 36+/-4 mA at 100 eV. For each multiplet the kinetic energy distribution function of each of the two fragment N atoms (ions) is much broader than thermal with a mean energy above 1.0 eV. The dissociation process with the largest cross section is predissociation and predominantly produces N atoms with kinetic energy distributions having mean energies above 0.5 eV. Dissociative processes can lead to a substantial escape flux of N I atoms from the satellites, Titan and Triton of the outer planets.

Ajello, Joseph M.↗
DOE OSTI2018

YAG:Er{sup 3+}, CaF{sub 2}:Er{sup 3+}, and Er{sub 2}O{sub 3} Emission Spectra Under Laser and Laser Thermal Excitation

Experimental luminescence and selective-emission (SE) spectra of YAG:Er{sup 3+} (10 at.%) and CaF{sub 2}:Er{sup 3+} (1 at.%) single crystals and Er{sub 2}O{sub 3} polycrystal under laser and laser thermal excitation of the Er3+-ion multiplets are compared. Luminescence spectra under resonant excitation are determined by multiplet population relaxation with the corresponding radiative and nonradiative probabilities. The form of the SE spectra is determined by the thermal population of the multiplets and the probabilities of only radiative transitions. The SE band at 800 nm ({sup 4}I{sub 9/2} → {sup 4}I{sub 15/2}) is an indicator of high-temperature thermal emission of Er{sup 3+} ions. The absence of this band in luminescence spectra is explained by the short lifetime of the τ({sup 4}I{sub 9/2}) level of 53 ns at T = 300 K.

36 MATERIALS SCIENCE↗
DOE OSTI2011

Search for signatures of magnetically-induced alignment in the arrival directions measured by the Pierre Auger Observatory

We present the results of an analysis of data recorded at the Pierre Auger Observatory in which we search for groups of directionally-aligned events (or ''multiplets'') which exhibit a correlation between arrival direction and the inverse of the energy. These signatures are expected from sets of events coming from the same source after having been deflected by intervening coherent magnetic fields. The observation of several events from the same source would open the possibility to accurately reconstruct the position of the source and also measure the integral of the component of the magnetic field orthogonal to the trajectory of the cosmic rays. We describe the largest multiplets found and compute the probability that they appeared by chance from an isotropic distribution. We find no statistically significant evidence for the presence of multiplets arising from magnetic deflections in the present data.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2014

Survey of Evaluated Isobaric Analog States

Isobaric analog states (IAS) can be used to estimate the masses of members belonging to the same isospin multiplet. Experimental and estimated IAS have been used frequently within the Atomic Mass Evaluation (AME) in the past, but the associated set of evaluated masses have been published for the first time in AME2012 and NUBASE2012. In this paper the current trends of the isobaric multiplet mass equation (IMME) coefficients are shown. The T = 2 multiplet is used as a detailed illustration.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2015

A NEW ANALYSIS OF THE TWO CLASSICAL ZZ CETI WHITE DWARFS GD 165 AND ROSS 548. I. PHOTOMETRY AND SPECTROSCOPY

We present the first of a two-part seismic analysis of the two bright hot ZZ Ceti stars GD 165 and Ross 548. In this first part, we report the results of frequency extraction exercises based on time-series data sets of exceptional quality. We uncovered up to 13 independent pulsation modes in GD 165, regrouped into six main frequency multiplets. These include 9 secure (signal-to-noise ratio, S/N > 4) detections and 4 possible ones (4 ≥ S/N ≥ 3). Likewise, we isolated 11 independent modes in Ross 548 (9 secure and 2 possible detections), also regrouped into 6 multiplets. The multiplet structure is likely caused by rotational splitting. We also provide updated estimates of the time-averaged atmospheric properties of these two pulsators in the light of recent developments on the front of atmospheric modeling for DA white dwarfs.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2026

Global symmetry and integral constraint on superconformal lines in four dimensions

We study properties of point-like impurities preserving flavor symmetry and supersymmetry in four-dimensional 𝒩 = 2 field theories. At large distances, such impurities are described by half-BPS superconformal line defects. By working in the AdS 2 × S 2 conformal frame, we develop a novel and simpler way of deriving the superconformal Ward identities relating the various two-point functions of flavor current multiplet operators in the presence of the defect. We use these relations to simplify a certain integrated two-point function of flavor current multiplet operators that, in Lagrangian theories, can be computed using supersymmetric localization. The simplification gives an integral constraint on the two-point function of the flavor current multiplet superconformal primary with trivial integration measure in the AdS 2 × S 2 conformal frame. We provide several consistency checks on our Ward identities.

extended supersymmetry↗
DOE OSTI2021

\( \mathcal{N} \) = 2 supersymmetric partially massless fields and other exotic non-unitary superconformal representations

We find and classify the simplest \( \mathcal{N} \) = 2 SUSY multiplets on AdS 4 which contain partially massless fields. We do this by studying representations of the \( \mathcal{N} \) = 2, d = 3 superconformal algebra of the boundary, including new shortening conditions that arise in the non-unitary regime. Unlike the \( \mathcal{N} \) = 1 case, the simplest \( \mathcal{N} \) = 2 multiplet containing a partially massless spin-2 is short, containing several exotic fields. More generally, we argue that \( \mathcal{N} \) = 2 supersymmetry allows for short multiplets that contain partially massless spin- s particles of depth t = s – 2.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2016

Deformations of superconformal theories

Here, we classify possible supersymmetry-preserving relevant, marginal, and irrelevant deformations of unitary superconformal theories in d ≥ 3 dimensions. Our method only relies on symmetries and unitarity. Hence, the results are model independent and do not require a Lagrangian description. Two unifying themes emerge: first, many theories admit deformations that reside in multiplets together with conserved currents. Such deformations can lead to modifications of the supersymmetry algebra by central and noncentral charges. Second, many theories with a sufficient amount of supersymmetry do not admit relevant or marginal deformations, and some admit neither. The classification is complicated by the fact that short superconformal multiplets display a rich variety of sporadic phenomena, including supersymmetric deformations that reside in the middle of a multiplet. We illustrate our results with examples in diverse dimensions. In particular, we explain how the classification of irrelevant supersymmetric deformations can be used to derive known and new constraints on moduli-space effective actions.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2015

6d $ \mathcal{N}=\left(1,\;0\right) $ theories on S 1 /T 2 and class S theories: part II

Here, we study the T 2 compactification of a class of 6d $ \mathcal{N}=\left(1,\;0\right) $ theories that is Higgsable to $ \mathcal{N}=\left(2,\;0\right) $ theories. We show that the resulting 4d N=2 theory at the origin of the Coulomb branch and the parameter space is generically given by two superconformal matter sectors coupled by an infrared-free gauge multiplet and another conformal gauge multiplet. Our analysis utilizes the 5d theories obtained by putting the same class of 6d theories on S 1 . Our class includes, among others, the 6d theories describing multiple M 5 branes on an ALE singularity, and we analyze them in detail. The resulting 4d theory has manifestly both the SL(2,Z) and the full flavor symmetry. We also discuss in detail the special cases of 6d theories where the infrared-free gauge multiplet is absent. In an appendix, we give a field-theoretical argument for an F-theoretic constraint that forbids a particular 6d anomaly-free matter content, as an application of our analysis.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2017

First-Principles Fe L 2,3 -Edge and O K-Edge XANES and XMCD Spectra for Iron Oxides

X-ray absorption near-edge structure (XANES) and X-ray magnetic circular dichroism (XMCD) spectroscopies are tools in widespread use for providing detailed local atomic structure, oxidation state, and magnetic structure information for materials and organometallic complexes. The analysis of these spectra for transition-metal L-edges is routinely performed on the basis of ligand-field multiplet theory because one- and two-particle mean-field ab initio methods typically cannot describe the multiplet structure. Here we show that multireference configuration interaction (MRCI) calculations can satisfactorily reproduce measured XANES spectra for a range of complex iron oxide materials including hematite and magnetite. MRCI Fe L2,3-edge XANES and XMCD spectra of Fe(II)O6, Fe(III)O6, and Fe(III)O4 in magnetite are found to be in very good qualitative agreement with experiment and multiplet calculations. Point-charge embedding and small distortions of the first-shell oxygen ligands have only small effects. Oxygen K-edge XANES/XMCD spectra for magnetite investigated by a real-space Green’s function approach complete the very good qualitative agreement with experiment. Material-specific differences in local coordination and site symmetry are well reproduced, making the approach useful for assigning spectral features to specific oxidation states and coordination environments.

Environmental Molecular Sciences Laboratory↗
DOE OSTI2019

Large Positive Zero-Field Splitting in the Cluster Magnet Ba 3 CeRu 2 O 9

Herein we present the synthesis and magnetic characterization of a polycrystalline sample of the 6H-perovskite Ba 3 CeRu 2 O 9 , which consists of Ru dimers based on face-sharing RuO 6 octahedra. Our low-temperature magnetic susceptibility, magnetization, and neutron powder diffraction results reveal a nonmagnetic singlet ground state for the dimers. Inelastic neutron scattering, infrared spectroscopy, and the magnetic susceptibility over a wide temperature range are best explained by a molecular orbital model with a zero-field splitting parameter D = 85 meV for the S tot = 1 electronic ground-state multiplet. This large value is likely due to strong mixing between this ground-state multiplet and low-lying excited multiplets, arising from a sizable spin molecular orbital coupling combined with an axial distortion of the Ru 2 O 9 units. Although the positive sign for the splitting ensures that Ba 3 CeRu 2 O 9 is not a single molecule magnet, our work suggests that the search for these interesting materials should be extended beyond Ba 3 CeRu 2 O 9 to other molecular magnets based on metal–metal bonding.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2011

SU(3) chiral symmetry for baryons

Three-quark nucleon interpolating fields in QCD have well-defined SU{sub L}(3)xSU{sub R}(3) and U{sub A}(1) chiral transformation properties, viz. [(6,3)+(3,6)], [(3,3-bar)+(3-bar,3)], [(8,1)+(1,8)] and their 'mirror' images. It has been shown (phenomenologically) in Ref. [2] that mixing of the [(6,3)+(3,6)] chiral multiplet with one ordinary ('naive') and one 'mirror' field belonging to the [(3,3-bar)+(3-bar,3)], [(8,1)+(1,8)] multiplets can be used to fit the values of the isovector (g{sub A}{sup (3)}) and the flavor-singlet (isoscalar) axial coupling (g{sub A}{sup (0)}) of the nucleon and then predict the axial F and D coefficients, or vice versa, in reasonable agreement with experiment. In an attempt to derive such mixing from an effective Lagrangian, we construct all SU{sub L}(3)xSU{sub R}(3) chirally invariant non-derivative one-meson-baryon interactions and then calculate the mixing angles in terms of baryons' masses. It turns out that there are (strong) selection rules: for example, there is only one non-derivative chirally symmetric interaction between J 1/2 fields belonging to the [(6,3)+(3,6)] and the [(3,3-bar)+(3-bar,3)] chiral multiplets, that is also U{sub A}(1) symmetric. We also study the chiral interactions of the [(3,3-bar)+(3-bar,3)] and [(8,1)+(1,8)] nucleon fields. Again, there are selection rules that allow only one off-diagonal non-derivative chiral SU{sub L}(3)xSU{sub R}(3) interaction of this type, that also explicitly breaks the U{sub A}(1) symmetry. We use this interaction to calculate the corresponding mixing angles in terms of baryon masses and fit two lowest lying observed nucleon (resonance) masses, thus predicting the third (J = 1/2, I = 3/2){Delta} resonance, as well as one or two flavor-singlet {Lambda} hyperon(s), depending on the type of mixing. The effective chiral Lagrangians derived here may be applied to high density matter calculations.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗
DOE OSTI2013

A combined DFT and restricted open-shell configuration interaction method including spin-orbit coupling: Application to transition metal L-edge X-ray absorption spectroscopy

A novel restricted-open-shell configuration interaction with singles (ROCIS) approach for the calculation of transition metal L-edge X-ray absorption spectra is introduced. In this method, one first calculates the ground state and a number of excited states of the non-relativistic Hamiltonian. By construction, the total spin is a good quantum number in each of these states. For a ground state with total spin S excited states with spin S Prime = S, S - 1, and S + 1 are constructed. Using Wigner-Eckart algebra, all magnetic sublevels with M{sub S}= S, Horizontal-Ellipsis , -S for each multiplet of spin S are obtained. The spin-orbit operator is represented by a mean-field approximation to the full Breit-Pauli spin-orbit operator and is diagonalized over this N-particle basis. This is equivalent to a quasi-degenerate treatment of the spin-orbit interaction to all orders. Importantly, the excitation space spans all of the molecular multiplets that arise from the atomic Russell-Saunders terms. Hence, the method represents a rigorous first-principles approach to the complicated low-symmetry molecular multiplet problem met in L-edge X-ray absorption spectroscopy. In order to gain computational efficiency, as well as additional accuracy, the excitation space is restricted to single excitations and the configuration interaction matrix is slightly parameterized in order to account for dynamic correlation effects in an average way. To this end, it is advantageous to employ Kohn-Sham rather than Hartree-Fock orbitals thus defining the density functional theory/ROCIS method. However, the method can also be used in an entirely non-empirical fashion. Only three global empirical parameters are introduced and have been determined here for future application of the method to any system containing any transition metal. The three parameters were carefully calibrated using the L-edge X-ray absorption spectroscopy spectra of a test set of coordination complexes containing first row transition metals. These parameters are universal and transferable. Hence, there are no adjustable parameters that are used to fit experimental X-ray absorption spectra. Thus, the new approach classifies as a predictive first-principles method rather than an analysis tool. A series of calculations on transition metal compounds containing Cu, Ti, Fe, and Ni in various oxidation and spin states is investigated and a detailed comparison to experimental data is reported. In most cases, the approach yields good to excellent agreement with experiment. In addition, the origin of the observed spectral features is discussed in terms of the electronic structure of the investigated compounds.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2019

General framework for calculating spin–orbit couplings using spinless one-particle density matrices: Theory and application to the equation-of-motion coupled-cluster wave functions

Standard implementations of nonrelativistic excited-state calculations compute only one component of spin multiplets (i.e., Ms = 0 triplets); however, matrix elements for all components are necessary for deriving spin-dependent experimental observables. Wigner–Eckart’s theorem allows one to circumvent explicit calculations of all multiplet components. We generate all other spin–orbit matrix elements by applying Wigner–Eckart’s theorem to a reduced one-particle transition density matrix computed for a single multiplet component. In addition to computational efficiency, this approach also resolves the phase issue arising within Born–Oppenheimer’s separation of nuclear and electronic degrees of freedom. A general formalism and its application to the calculation of spin–orbit couplings using equation-of-motion coupled-cluster wave functions are presented. The two-electron contributions are included via the mean-field spin–orbit treatment. Intrinsic issues of constructing spin–orbit mean-field operators for open-shell references are discussed, and a resolution is proposed. The method is benchmarked by using several radicals and diradicals. The merits of the approach are illustrated by a calculation of the barrier for spin inversion in a high-spin tris(pyrrolylmethyl)amine Fe(II) complex.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2014

2π1ν states populated in 135Te from 9Be-induced reactions with a 132Sn beam

γ-ray transitions in 134Te, 135Te, and 136Te were measured from 9Be-induced reactions with a radioactive 132Sn beam at a sub-Coulomb barrier energy of 3 MeV per nucleon using particle-γ coincidence spectroscopy. The transitions were selected by gating on alpha-like particles in a CsI detector following a combination of (9Be,α1n), (9Be,α2n), and (9Be,α3n) incomplete fusion-evaporation reactions. Distorted-wave Born approximation calculations suggest little to no contribution from the (9Be,7He), (9Be,6He), and (9Be,5He) direct reactions.γ-ray transitions from previously known 2+Ⓧν2f7/2 and 4+Ⓧν2f7/2 multiplet members in 135Te are observed. A new γ ray is observed, assigned to the third-excited state in 135Te, and new 2+Ⓧν2f7/2 multiplet members are suggested. In addition, spin assignments are made by using recent one-neutron transfer data. The updated experimental data for 135Te are compared to shell-model calculations for a relatively complete set of states up to the yrast 15/2-,4+Ⓧν2f7/2 multiplet member at 1505 keV.

Allmond, James M.↗
DOE OSTI2024

Model-independent predictions for decays of double-heavy hadrons into pairs of heavy hadrons

Double-heavy hadrons can decay into pairs of heavy hadrons through transitions from confining Born-Oppenheimer potentials to heavy-hadron-pair potentials with the same Born-Oppenheimer quantum numbers. The states of the double-heavy hadron are constrained by a Born-Oppenheimer exclusion principle from the identical heavy quarks. The states of a pair of identical heavy hadrons are constrained by exclusion principles from identical particles. The transitions are also constrained by conservation of angular momentum and parity. From these constraints, we derive model-independent selection rules for decays of double-heavy hadrons into pairs of heavy hadrons. The coupling potentials are expressed as sums of products of Born-Oppenheimer transition amplitudes and angular-momentum coefficients. If there is a single dominant Born-Oppenheimer transition amplitude, it factors out of the coupling potentials between double-heavy hadrons in the same Born-Oppenheimer multiplet and pairs of heavy hadrons in specific heavy-quark-spin-symmetry multiplets and out of the corresponding partial decay rates. As examples, we discuss the Born-Oppenheimer potentials and multiplets for conventional double-heavy baryons and for double-heavy tetraquark mesons. We also discuss the relative partial decay rates for conventional double-heavy baryons into pairs of heavy hadrons.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗