SEARCH · Search NASA
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.
Quote a phrase for an exact phrase match. Source license links do not imply unrestricted reuse.
The nonlinear diffraction on periodic microdomain structures with different orientations of the spontaneous polarisation axis relative to the surface is theoretically considered. The possibility of reliable non-destructive diagnostics of the period, duty cycle and depth of domain structures, as well as of the shape of the domain walls under the crystalline surface is shown. (nonlinear optical phenomena)
Photoproduction in ultra-peripheral relativistic heavy-ion collisions displays many unique features, often involving quantum mechanical coherence and two-source interference between photon emission from the two ions. We review the recent experimental results from RHIC and the LHC and theoretical studies of coherent vector meson photoproduction, emphasizing the quantum mechanical aspects of the interactions and the entanglement between the final state particles. These studies enrich our understanding of non-local realism, underscore the critical role of the polarization of the photon source, quantum interference and nuclear effect on the gluon distribution. It paves a way for quantitatively probing the quantum nature of these high-energy nuclear collisions.
Novel spinel neodymium-tin ferrite nanoparticles (Nd{sub 0.5}Sn{sub 0.5}Fe{sub 2}O{sub 4}) have been synthesized by the coprecipitation method; x-ray diffraction (XRD), transmission electron microscopy (TEM), and superconducting quantum interference device magnetometer (SQUID) techniques were used to characterize the crystal structure, morphology, and magnetic properties. The spinel structure of a single phase is obtained according to XRD results. From TEM characterization results, we obtained a spherical morphology with an average of 13 nm. Magnetic measurement indicates that the nanoparticles have a superparamagnetic phase with a corresponding blocking temperature (T{sub B}) of about 360 K. These new nanomaterials can potentially be used in nanoelectronic devices, magnetic sensors, and hyperthermia application.
Within the framework of the scalar and rigorous diffraction theory based on solving a system of Maxwell equations, saw-tooth relief-phase three-layer microstructures designed for the work with polychromatic radiation of the mid-IR range (3 ≤ λ ≤ 5 μm) are studied. The series of effective microstructures composed of different optical materials is extended, and the depths of their reliefs are minimized. The series is extended, in particular, owing to microstructures in which Fresnel losses for reflection from both reliefs do not exceed 10%. This factor, in combination with the relatively low total relief depth, can turn out to be decisive when choosing one or another microstructure for solving a specific scientific or technological problem.
Abstract Reacting praseodymium(IV) oxide with oxygen at 27 GPa in a diamond anvil cell yielded the oxide peroxide Pr 2 IV (O 2 )O 3 , which was characterized by single crystal X‐ray diffraction on multi‐grain samples, Raman spectroscopy and quantum theoretical calculations at various pressure points. The presence of tetravalent praseodymium ions is supported by electronic structure calculations, showing a band gap of ca. 1.2 eV, which is consistent with the anticipated chemical model of an ionic solid. Pr 2 (O 2 )O 3 thus far represents the most oxygen rich phase of any binary compound of a lanthanoid and oxygen and is the first example of a peroxide anion next to Pr 4+ . Additionally, these results demonstrate that instead of oxidizing the praseodymium ions past their +IV oxidation state, oxygen undergoes a comproportionation to form peroxide anions. Direct oxidation of the oxide anions by Pr 4+ ‐ions was ruled out by a control experiment in argon instead of oxygen, where no oxidation of oxide ions was observed.
Not Available
The fate of virtually all photochemical reactions is determined by conical intersections. These are energetically degenerate regions of molecular potential energy surfaces that strongly couple electronic states, thereby enabling fast relaxation channels. Their direct spectroscopic detection relies on weak features that are often buried beneath stronger, less interesting contributions. For azobenzene photoisomerization, a textbook photochemical reaction, we demonstrate how a resonant infrared field can be employed during the conical intersection passage to significantly enhance its coherence signatures in time-resolved Xray diffraction while leaving the product yield intact. Furthermore, this transition-state amplification holds promise to bring signals of conical intersections above the detection threshold.
Magnetic exchange coupling is difficult to foster in polynuclear lanthanide (Ln) complexes and poorly understood. While coupling Ln ions through closed-shell ligands is inherently weak due to the contracted 4f orbitals, placing open-shell ligands instead has proven to promote orders of magnitude stronger coupling, giving rise to single-molecule magnets (SMMs) innate to real magnetic memory effect in the case of the anisotropic Ln ions. Notably, the impact of radical bridges with differing oxidation states on magnetic blocking remains unexplored due to lack of Ln SMMs with radicals in two distinct charge states. Herein, the first dilanthanide complexes (Ln = Gd, Dy) containing fluoflavine (flv) bridges, [(Cp* 2 Ln) 2 (μ-flv z )]X, (where X = [Al(OC{CF 3 } 3 ) 4 ] − (z = 1−•), 1-Ln; X = 0 (z = 2−), 2-Ln; X =[K(crypt-222)] + (z = 3−•), 3-Ln) are reported. 1-Ln and 3-Ln, comprising the flv 1−• and flv 3−• radical bridges, were investigated via single-crystal X-ray diffraction (SCXRD), ultraviolet−visible (UV−vis) spectroscopy, Superconducting Quantum Interference Device (SQUID) magnetometry, high-field electron paramagnetic resonance (HF-EPR) spectroscopy and broken-symmetry density functional theory (BS-DFT) calculations. 1-Dy and 3-Dy constitute the first SMMs innate to radicals in two differing oxidation states. 1-Dy exhibits a spin-reversal barrier U eff of 28.36 cm −1 and open magnetic hysteresis loops below 3 K. By contrast, 3-Dy displays a much higher U eff of 143(2) cm −1 and open hysteresis loops until 9.5 K, representing a record for dilanthanide SMMs containing an organic radical bridge. The boost in SMM properties in 3-Dy is attributed to spin-phonon coupling and improved frontier orbital structure. This study paves the way for advanced design strategies of polynuclear Ln SMMs.
Hexagonal perovskite oxides with 12R stacking host well-separated face-sharing octahedral metal trimers with short metal–metal distances, leading in some cases to large degrees of magnetic frustration and cluster magnetism. Introducing magnetic ions in proximity to these trimers can influence the degree of frustration and cluster magnetism, but the extent to which the magnetism can be tuned by varying neighboring metal cations remains an open question. In this work, we test the impacts of using Nd in proximity to Mn trimers in the hexagonal perovskite 12R-Ba 4 NdMn 3 O 12−γ . Given this stoichiometry, Nd should assume the 4+ oxidation state with a spin state of S = 1, which would be the first realization of Nd 4+ in an oxide environment. Through detailed bulk magnetic, X-ray absorption spectroscopic, and powder neutron diffraction (PND) measurements, we find that Nd 4+ is realized in this material, but there is also partial reduction to Nd 3+ , which is charge-balanced by O vacancies. Magnetometry measurements indicate an antiferromagnetic ordering temperature T N ≈ 16 K, and PND measurements reveal a surprising collinear antiferromagnetic structure with magnetic space group Pc2/m (no. 10.49 in BNS notation), which has not previously been seen in this class of materials. Our results represent a comprehensive analysis of the structural, electronic, and magnetic properties of 12R-Ba 4 NdMn 3 O 12−γ , showing the first observation of partial Nd 4+ in an oxide, and demonstrating that this structural class can host a broad range of magnetic structures which are not easily predicted based on compositional trends.
Not Available
This dataset contains electron microscopy, magnetic, and X-ray diffraction characterization data for YIG/YSGG thin films associated with the manuscript "Magnetic anisotropy due to localized structural defects in strained yttrium iron garnet thin films". Characterizations include: scanning electron nano diffraction (SEND, or 4D-STEM), dark field transmission electron microscopy (DF-TEM), energy dispersive X-ray spectroscopy (EDS), ferrimagnetic resonance (FMR), superconducting quantum interference device (SQUID), scanning transmission electron microscopy (STEM), X-ray diffraction (XRD).
The study of Fraunhofer diffraction of a Gaussian laser beam by a computer-generated, binary four-sector grating (FSG) is presented. In the four equal angular sectors of the FSG, parts of a binary rectilinear grating are embedded in such a way that, two neighboring parts are shifted by a half spatial rectilinear grating period. Analytical expressions, describing the diffracted wave field amplitude and intensity distributions in the focal plane of a converging lens, are derived. The zeroth-diffraction-order beam is a Gaussian beam whose transverse cross section has a reduced Gaussian radius. The higher-diffraction-order beam transverse intensity profiles have four bright spots divided by dark crossed lines and a central dark, non-vortex core. They can be described as cosine-Laguerre–Gaussian Kummer beams. The numerically calculated diffraction patterns, as well as the interference patterns of the diffracted beam with a slightly inclined plane wave, are supported by experimentally obtained ones. In both investigations (theoretical and experimental) the interferograms confirm the non-vortex nature of the diffraction spots.
We have studied the features of noncollinear acousto-optic filtering of quasi-nondiffracting Bessel light beams in uniaxial crystals. We have obtained coupled wave equations for the vector amplitudes of an incident ordinary (o-type) Bessel beam and an extraordinary (e-type) diffracted beam for different modes. We have found an expression for the diffraction efficiency as a function of the parameters of interacting ordinary and extraordinary Bessel beams, and also as a function of the values of the overlap integrals. Using the overlap integral method, we have shown that regardless of the mode order for the Bessel light beam, under transverse phase matching conditions for ordinary and extraordinary diffracted Bessel beams in the optical spectral range 0.4–1.1 μm we can achieve a filter transmission bandwidth of ~0.6 nm in paratellurite crystals .
Abstract The chemistry of electrons in actinide complexes and materials is still poorly understood and represents a serious challenge and opportunity for experiment and theory. The study of the electron density distribution of the ground state of such systems through X‐ray diffraction represents a unique opportunity to quantitatively investigate different chemical bonding interactions at once, but was considered “almost impossible” on heavy‐atom systems, until very recently. Here, we present a combined experimental and theoretical investigation of the electron density distribution in UCl_ 4 crystals and comparison with the previously reported spin density distribution from polarized neutron diffraction. All approaches provide a consistent picture in terms of electron and spin density distribution, and chemical bond characterization. More importantly, the synergy between experiments and quantum‐mechanical calculations allows to highlight the remarkable sensitivity of X‐ray diffraction to electrons in materials.
We present a review of the recent theoretical and experimental developments related to the field of diffraction, parton saturation, and forward physics. We first discuss our present understanding of the proton structure in terms of quarks and gluons, the degrees of freedom of quantum chromodynamics. We then focus on some of the main results on diffraction at the HERA electron–proton collider in DESY, Germany, at the Tevatron proton–antiproton collider at Fermilab, Batavia, US, and at the CERN Large Hadron Collider (LHC) proton–proton and nucleus–nucleus collider, which is located in Geneva, Switzerland. We also present a selected amount of results on diffraction and photon exchanges that can be done at the LHC experiments and at a future Electron Ion Collider (EIC) to be built in the US at Brookhaven National Laboratory, New York.
Abstract A fundamental understanding of materials’ structural dynamics, with fine spatial and temporal control, underpins future developments in electronic and quantum materials. Here, we introduce an optical transient grating pump and focused X-ray diffraction probe technique (TGXD) to examine the structural evolution of materials excited by modulated light with a precisely controlled spatial profile. This method adds spatial resolution and direct structural sensitivity to the established utility of a sinusoidal transient-grating excitation. We demonstrate TGXD using two thin-film samples: epitaxial BiFeO 3 , which exhibits a photoinduced strain (structural grating) with an amplitude proportional to the optical fluence, and FeRh, which undergoes a magnetostructural phase transformation. In BiFeO 3 , structural relaxation is location independent, and the strain persists on the order of microseconds, consistent with the optical excitation of long-lived charge carriers. The strain profile of the structural grating in FeRh, in comparison, deviates from the sinusoidal excitation and exhibits both higher-order spatial frequencies and a location-dependent relaxation. The focused X-ray probe provides spatial resolution within the engineered optical excitation profile, resolving the spatiotemporal flow of heat through FeRh locally heated above the phase transition temperature. TGXD successfully characterizes mesoscopic energy transport in functional materials without relying on a specific transport model.
Noncollinear double acousto-optical diffraction of Bessel light beams on ultrasound in uniaxial gyrotropic crystals is studied theoretically and experimentally. It is found that when a Bessel light beam propagates along the optic axis of a crystal, the diffracted light beams of the ±1 order are symmetric relative to the incident beam and have roughly the same intensity. Double Bragg diffraction is also observed when a Bessel light beam is incident at the Bragg angle and near the optic axis, but the intensities of the +1 and +2 order diffracted beams are significantly different.
YbAgGe contains a magnetic geometrically frustrated kagome-like lattice that also features significant local single-ion anisotropy. The electronic state is established by hybridization of 4f and conduction electrons leading to heavy electronic masses. The competition between these various interactions leads to nontrivial behavior under external magnetic field, including a sequence of magnetic phase transitions, non-Fermi-liquid states, and possibly a quantum critical point. We present a series of neutron diffraction experiments performed in the mK temperature range and under magnetic fields up to 8 T in the hexagonal plane, revealing the microscopic nature of the first four subsequent magnetic states of this phase diagram. The magnetic phases are associated with the propagation vectors K 1 =($\frac{1}{3}$ 0 $\frac{1}{3}$) for H < 2 T, K 2 = (0 0 0.32) for 2 T < H < 3 T, K 1 = ($\frac{1}{3}$ 0 $\frac{1}{3}$) for 3 T < H < 4.5 T and k 3 = (0.195 0.195 0.38) for 4.5 T < H < 7 T. Our structural refinements reveal a strong modulation of the magnetic moment amplitude in all phases. We observe that the ordered moments of the three magnetically different Yb sites become increasingly different in field, which complies with the principle local anisotropy directions relative to the field direction. While the ordered moments are aligned predominantly in the hexagonal plane, we also find a significant out-of-plane component and a ferromagnetic contribution above 2 T. Here we discuss possible scenarios that may evolve around the phase boundary at 4.5 T, which is associated with putative quantum criticality as identified by various bulk probes. We propose further steps that are required to better understand the microscopic interactions in this material.