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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 289 records · Page 16
All sourcesNASA NTRSDOE OSTI
DOE OSTI2011

High-pressure Structural Stability of Multiferroic Hexagonal RMnO3 (R=Y Ho Lu)

Structural changes in RMnO{sub 3} (R = Y, Ho, Lu) under high pressure were examined by synchrotron x-ray diffraction methods at room temperature. Compression occurs more readily in the ab plane than along the c axis. With increased pressure, a pressure-induced hexagonal to orthorhombic phase transition was observed starting at {approx}22 GPa for Lu(Y)MnO{sub 3}. When the pressure is increased to 35 GPa, a small volume fraction of Lu(Y)MnO{sub 3} is converted to the orthorhombic phase and the orthorhombic phase is maintained on pressure release. High-pressure infrared absorption spectroscopy and Mn K-edge near-edge x-ray absorption spectroscopy confirm that the hexagonal P6{sub 3}cm structure is stable below {approx}20 GPa and the environment around the Mn ion is not changed. Shifts in the unoccupied p-band density of states with pressure are observed in the Mn K-edge spectra. A schematic pressure-temperature phase diagram is given for the small ion RMnO{sub 3} system.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2017

Dynamical generation of superconducting order of different symmetries in hexagonal lattices

The growth of superconducting order after an interaction quench in a hexagonal lattice is studied. The cases of both time-reversal (TR) preserving graphene, as well as the TR broken Haldane model are explored. Spin singlet superconducting order is studied where the s, d+id, and d-id wave orders are the irreducible representations of the hexagonal lattice. For small quenches, the d-wave order parameter grows the fastest, a result also expected when the system is in thermal equilibrium. For the TR symmetry preserving case, the growth rate of the two d-wave orders is identical, while the TR-broken case prefers one of the chiral d-wave orders over the other, leading to a TR broken topological superconductor. As the interaction quench becomes larger, a smooth crossover is found where eventually the growth rate of the s-wave becomes the largest. Therefore for large interaction quenches, the s-wave is preferred over the d-wave for both TR preserving and TR broken systems. Our result is explained in terms of the high energy quasi-particles responsible for the dynamics as the interaction quench amplitude grows. The results are relevant for time-resolved measurements that can probe the symmetry of the superconducting fluctuations in a transient regime.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2018

Inner Phases of Colloidal Hexagonal Spin Ice

Using numerical simulations that mimic recent experiments on hexagonal colloidal ice, here we show that colloidal hexagonal artificial spin ice exhibits an inner phase within its ice state that has not been observed previously. Under increasing colloid-colloid repulsion, the initially paramagnetic system crosses into a disordered ice regime, then forms a topologically charge ordered state with disordered colloids, and finally reaches a threefold degenerate, ordered ferromagnetic state. This is reminiscent of, yet distinct from, the inner phases of the magnetic kagome spin ice analog. Finally, the difference in the inner phases of the two systems is explained by their difference in energetics and frustration.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2019

Topological Semimetal features in the Multiferroic Hexagonal Manganites

Using first-principles calculations we investigate the band structures of ferromagnetic hexagonal manganites $\mathrm{YXO_3}$ (X=V, Cr, Mn, Fe and Co) in the nonpolar nonsymmorphic $P6_3/mmc$ space group. For $\mathrm{YVO_3}$ and $\mathrm{YCrO_3}$ we find a band inversion near the Fermi energy that generates a nodal ring in the $k_z=0$ mirror plane. We perform a more detailed analysis for these compounds and predict the existence of the topological "drumhead" surface states. Finally, we briefly discuss the low-symmetry polar phases (space group $P6_3cm$) of these systems, and show they can undergo a $P6_3/mmc \rightarrow P6_3cm$ transition by condensation of soft $K_3$ and $\Gamma_2^-$ phonons. Based on our results, stabilizing these compnds in the hexagonal phase could offer a promising platform for studying the interplay of topology and multiferroicity, and the coexistence of real-space and reciprocal-space topological protection in the same phase.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2017

Pressure Measurements in a Wire-Wrapped 61-Pin Hexagonal Fuel Bundle

To achieve longer-life liquid-metal fast reactor cores, designers are considering to increase the wall gap of the wire-wrapped hexagonal fuel bundles to account for volumetric void swelling and radiation creep. A new wire-wrapped hexagonal test bundle has been constructed, with a wall gap larger than prior experiments, and experimental pressure drop data have been generated under laminar, transition, and turbulent flow regimes (corresponding to Re of 250–19,000), to complement the existing database of small wall gap experimental bundles. The comparison of the experimental data set with the predictions of four existing correlations (Baxi and Dalle Donne, Cheng and Todreas detailed (CTD), Kirillov, and Rehme) showed general agreement between data and the selected correlations. However, the CTD correlation most accurately predicted the experimental trend and the transition between flow regimes. The analysis of the experimental data also revealed that the larger wall gap size caused a lower bundle pressure drop due to the increased bypass flow area.

42 ENGINEERING↗
DOE OSTI2013

Excitation of intense acoustic waves in hexagonal crystals

Resonant excitation of an intense elastic wave using reflection of a pump wave from a free surface of hexagonal crystal is described. A resonance arises in the case of specially chosen propagation geometry where the reflecting boundary slightly deviates from symmetric orientation and the propagation direction of an intense reflected wave is close to that of an exceptional bulk wave, which satisfies the free boundary condition in unperturbed symmetric orientation. It is shown that, in crystals with elastic moduli c{sub 44}>c{sub 66}, a resonance arises when the initial boundary is chosen parallel to the hexagonal axis 6, whereas in crystals characterized by the relation c{sub 44}<c{sub 66} a resonance occurs when the initial boundary is orthogonal to this axis. The fraction of the pump energy transferred to the excited beam depends on the specific relations between the elastic moduli and can be rather significant for specially chosen crystals. Examples of crystals are presented in which the beam intensity can be increased by a factor of 5-10 at sufficiently high frequencies, with beam divergence remaining acceptable.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2015

Surface states in a 3D topological insulator: The role of hexagonal warping and curvature

We explore a combined effect of hexagonal warping and a finite effective mass on both the tunneling density of electronic surface states and the structure of Landau levels of 3D topological insulators. We find the increasing warping to transform the square-root van Hove singularity into a logarithmic one. For moderate warping, an additional logarithmic singularity and a jump in the tunneling density of surface states appear. By combining the perturbation theory and the WKB approximation, we calculate the Landau levels in the presence of hexagonal warping. We predict that due to the degeneracy removal, the evolution of Landau levels in the magnetic field is drastically modified.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2018

Magnetostriction of Hexagonal HoMnO{sub 3} and YMnO{sub 3} Single Crystals

We report on the magnetostriction of hexagonal HoMnO{sub 3} and YMnO{sub 3} single crystals in a wide range of applied magnetic fields (up to H = 14 T) at all possible combinations of the mutual orientations of magnetic field H and magnetostriction ΔL/L. The measured ΔL/L(H, T) data agree well with the magnetic phase diagram of the HoMnO{sub 3} single crystal reported previously by other authors. It is shown that the nonmonotonic behavior of magnetostriction of the HoMnO{sub 3} crystal is caused by the Ho{sup 3+} ion; the magnetic moment of the Mn{sup 3+} ion parallel to the hexagonal crystal axis. The anomalies established from the magnetostriction measurements of HoMnO{sub 3} are consistent with the phase diagram of these compounds. For the isostructural YMnO{sub 3} single crystal with a nonmagnetic rare-earth ion, the ΔL/L(H, T) dependences are described well by a conventional quadratic law in a wide temperature range (4–100 K). In addition, the magnetostriction effect is qualitatively estimated with regard to the effect of the crystal electric field on the holmium ion.

75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND↗
DOE OSTI2014

Hexagonal OsB 2 reduction upon heating in H 2 containing environment

The stability of hexagonal ReB 2 type OsB 2 powder upon heating under reforming gas was investigated. Pure Os metal particles were detected by powder X-ray diffraction starting at 375⁰ C and complete transformation of OsB 2 to metallic Os was observed at 725⁰ C. The mechanisms of precipitation of metallic Os is proposed and changes in the lattice parameters of OsB 2 upon heating are analysed in terms of the presence of oxygen or water vapour in the heating chamber. Previous studies suggested that Os atoms possess (0) valence, while B atoms possess both (+3) and ( 3) valences in the alternating boron/osmium sheet structure of hexagonal (P63/mmc, No. 194) OsB 2 ; if controllable method for Os removal from the lattice could be found, the opportunity would arise to form two-dimensional (2D) layers consisting of pure B atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2023

Design tradeoffs between traditional hexagonal and emerging cubic In X Ga (1–X) N/GaN-based green light-emitting diodes

Here, we report on the design tradeoffs between traditional hexagonal and emerging cubic In X Ga (1–X) N/GaN -based green (520 nm≤ λ ≤550 nm) light-emitting diodes with special emphasis on the electron blocking layer, number of quantum wells, and thicknesses of quantum wells and barriers. We identified three crucial design rules for cubic green light-emitting diodes: (1) no need for an electron blocking layer; (2) use of a wide quantum well; and (3) choice of thin quantum barriers in multi-quantum well light-emitting diode designs. These design rules increase the internal quantum efficiency of cubic green light-emitting diodes by ~30.5% under 100A/cm 2 injection with respect to traditional designs. Overall, the design rules of cubic light-emitting diodes and their differentiating nature from the traditional, hexagonal ones are crucial for the advent of next-generation cubic light-emitting diodes.

42 ENGINEERING↗
DOE OSTI2023

Zagamiite, CaAl2Si3.5O11, the Hexagonal High-Pressure CAS Phase with Dominant Si, as a Mineral from Mars

Within the Ca-Al-silicate system, dense, layered hexagonal phases occur at high temperatures and pressures between 20 and 23 GPa. They have been observed both in nature and in experiments. In this study, we describe the endmember with a dominant sixfold coordinated Si as a mineral zagamiite (IMA 2015-022a). This new mineral identified in Martian meteorites has a general formula of (Ca,Na)(Al,Fe,Mg)2(Si,Al,□)4O11, thus defining CaAl2Si3.5O11 as a previously unknown endmember of the hexagonal CAS phases. Zagamiite assumes space group P63/mmc with a unit cell of a = 5.403(2) Å, c = 12.77(3) Å, V = 322.9(11) Å3, and Z = 2. Zagamiite contains significant Fe and Mg and a substantial deficit of Na relative to plagioclase of an equivalent Al/Si, suggesting that it was formed through crystallization from a melt that was derived from a plagioclase-dominant mixture of plagioclase and clinopyroxene above the solidus beyond 20 GPa.

Ma, Chi (ORCID:0000000218287033)↗
NASA NTRS1978

Hexagon solar power panel

A solar energy panel support is described upon which silicon cells are arrayed. The cells are wafer thin and of two geometrical types, both of the same area and electrical rating, namely hexagon cells and hourglass cells. The hourglass cells are composites of half hexagons. A near perfect nesting relationship of the cells achieves a high density packing whereby optimum energy production per panel area is achieved.

Rubin, I.↗
NASA NTRS1978

Solar concentrating properties of truncated hexagonal, pyramidal and circular cones

The solar concentrating properties of specularly reflecting truncated pyramidal, hexagonal, and circular cones are evaluated. Pyramidal and hexagonal configurations are discussed with reference to the concentration factor as a function of half apex angle and the length of the side over the width, and to the irradiance distribution. Expressions are derived for the concentration factor and the irradiance at the base of a circular cone when the sunlight is incident normal to the aperture and for oblique incidence.

Burkhard, D. G.↗
NASA NTRS1979

The structure of small, vapor-deposited particles. II - Experimental study of particles with hexagonal profile

'Multiply-twinned' gold particles with hexagonal bright field TEM profile were determined to be icosahedra composed of 20 identical and twin-related tetrahedral building units that do not have an fcc structure. The crystal structure of these slightly deformed tetrahedra is rhombohedral. Experimental evidence supporting this particle model was obtained by selected-zone dark field and weak beam dark field electron microscopy. In conjunction with the results of part I, it has been concluded that multiply-twinned gold particles of pentagonal or hexagonal profile that are found during the early stages of the vapor deposition growth process on alkali halide surfaces do not have an fcc crystal structure, which is in obvious contrast to the structure of bulk gold.

Yacaman, M. J.↗
NASA NTRS1986

Thermal expansion of the hexagonal (4H) polytype of SiC

The principal axial coefficients of thermal expansion, alpha(11) and alpha(33), of the (4H) polytype of hexagonal alpha SiC have been determined by X-ray diffraction measurements in the temperature range 20-1000 C. Alpha(11) and alpha(33), derived from the lattice parameter measurements, were expressed as the second-order polynomials in temperature. Alpha(11) was found to be larger than alpha(33) over the entire temperature range, with a thermal expansion anisotropy factor A increasing from 0.04 at room temperature to 0.11 at 1000 C. The thermal expansion results for the (4H) structure were compared with previously published results for the cubic (3C) and the hexagonal (6H) SiC polytypes.

Li, Z.↗
NASA NTRS1988

The single crystal elastic constants of hexagonal SiC to 1000 C

The relationships between the sound velocities in the cubic and hexagonal crystal structures and the tensor transformations for the two structures are applied to determine the elastic stiffnesses for the hexagonal structures of SiC to 1000 C. These results are then applied to calculate the polycrystalline elastic moduli, E and G, and their temperature variations. The calculated values for E and G at 20 C are 420 and 180 GPa; for (dE/dT) and (dG/dT), the values are -0.020 and -0.007 GPa/C, respectively.These agree well with published experimental values for E and G of dense polycrystalline alpha silicon carbides.

Li, Z.↗
NASA NTRS2011

Epitaxial Growth of Cubic Crystalline Semiconductor Alloys on Basal Plane of Trigonal or Hexagonal Crystal

Hetero-epitaxial semiconductor materials comprising cubic crystalline semiconductor alloys grown on the basal plane of trigonal and hexagonal substrates, in which misfit dislocations are reduced by approximate lattice matching of the cubic crystal structure to underlying trigonal or hexagonal substrate structure, enabling the development of alloyed semiconductor layers of greater thickness, resulting in a new class of semiconductor materials and corresponding devices, including improved hetero-bipolar and high-electron mobility transistors, and high-mobility thermoelectric devices.

Park, Yeonjoon↗