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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 19 records
All sourcesNASA NTRSDOE OSTI
DOE OSTI2025

4f-orbital covalency enables a single-crystal-to-single-crystal ring-opening isomerization in a CeIV–cyclopropenyl complex

Metal–ligand bonding interactions for f-element compounds are typically highly polarized with only minor covalent character. Whereas the 5d/6d orbitals are known to be chemically accessible for dative bonding, recent quantum chemical and spectroscopic analyses have indicated appreciable 4f/5f-orbital involvement in certain metal–ligand bonds. However, 4f-orbital covalency has not been compellingly linked to distinctive modes of chemical reactivity via rigorous comparative study and mechanistic investigation. Here a series of MIV–cyclopropenyl complexes (M = Ti, Zr, Ce, Hf, Th) are described, wherein the cerium congener exhibits a 4f-covalent Ce=Cα interaction, causing a ring-opening isomerization reaction through a single-crystal-to-single-crystal transformation. The results provide evidence for 4f-orbital covalency by demonstrating its expression in the reactivity of an f-element complex within an isostructural series of tetravalent d- and f-block metal complexes. They also provide new directions for the study of orbital covalency effects of molecular compounds in solid-state chemical transformations.

Vincenzini, Brett D↗
NASA NTRS1985

Creep-fatigue behavior of NiCoCrAlY coated PWA 1480 superalloy single crystals

Single crystal specimens of a Ni base superalloy, PWA 1480, with a low pressure plasma sprayed NiCoCrAlY coating were tested in various 0.1 Hz fatigue and creep fatigue cycles both at 1015 and 1050 C. Creep fatigue tests of the cp, pc, and cc types were conducted with various constant total strain ranges employing creep dwells at various constant stresses. Considerable cyclic softening occurred as was evidenced particularly by rapidly increasing creep rates in the creep fatigue tests. The cycle time in the creep fatigue tests typically decreased by more than 80 percent at 0.5 N sub f. Though cyclic life did correlate with delta epsilon sub in a better correlation existed with sub f for both the fatigue and creep fatigue tests, and poor correlations were observed with either sigma sub max or the average cycle time. A model containing both delta sigma and delta sigma (sub in), N sub f = alpha delta sigma (sub in) beta delta sigma gamma, with best fit values of sigma for each cycle type, but the same values of beta and gamam, was found to provide good correlations. Life lines were not greatly different among the cycle types, differing only by a factor of about three. The cp cycle life line was lowest for both test temperatures, however among the other three cycle types there was no consistent ranking. For all test types failure occurred predominately by multiple internal cracking originating at pores. The strong correlation of life with delta sigma may reflect a significant crack growth period in the life of the specimens.

Miner, R. V.↗
NASA NTRS1988

Creep-fatigue behavior of NiCoCrAlY coated PWA 1480 superalloy single crystals

Single crystal specimens of a Ni base superalloy, PWA 1480, with a low pressure plasma sprayed NiCoCrAlY coating were tested in various 0.1 Hz fatigue and creep fatigue cycles both at 1015 and 1050 C. Creep fatigue tests of the cp, pc, and cc types were conducted with various constant total strain ranges employing creep dwells at various constant stresses. Considerable cyclic softening occurred as was evidenced particularly by rapidly increasing creep rates in the creep fatigue tests. The cycle time in the creep fatigue tests typically decreased by more than 80 percent at 0.5 N sub f. Though cyclic life did correlate with delta epsilon sub in a better correlation existed with sub f for both the fatigue and creep fatigue tests, and poor correlations were observed with either sigma sub max or the average cycle time. A model containing both delta sigma and delta sigma (sub in), N sub f = alpha delta sigma (sub in) beta delta sigma gamma, with best fit values of sigma for each cycle type, but the same values of beta and gamam, was found to provide good correlations. Life lines were not greatly different among the cycle types, differing only by a factor of about three. The cp cycle life line was lowest for both test temperatures, however among the other three cycle types there was no consistent ranking. For all test types failure occurred predominately by multiple internal cracking originating at pores. The strong correlation of life with delta sigma may reflect a significant crack growth period in the life of the specimens.

Miner, R. V.↗
NASA NTRS1992

On the growth of Hg2Cl(1-x)2Br(x2) single crystals

Single crystals of mixed mercurous halides Hg2X2 (where X = Cl and Br) were grown by the physical vapor transport process. Structural parameters and optical properties were determined to examine the suitability of mixed crystals for acoustooptic devices. Mixed crystals grown in the low concentration region did not show striations or banding. Crystals grown in the high concentration region showed considerable inhomogeneity in the refractive index. Since we had used identical thermal conditions, inhomogeneity was attributed to the solutal convection caused by the difference in densities of mercurous chloride and bromide vapors. A low concentration of dopant did not change the acoustic velocity of the parent components.

Singh, N. B.↗
NASA NTRS1990

Method of making single crystal fibers

Single crystal fibers are made from miniature extruded ceramic feed rods. A decomposable binder is mixed with powders to inform a slurry which is extruded into a small rod which may be sintered, either in air or in vacuum, or it may be used in the extruded and dried condition. A pair of laser beams focuses onto the tip of the rod to melt it thereby forming a liquid portion. A single crystal seed fiber of the same material as the feed rod contacts this liquid portion to establish a zone of liquid material between the feed rod and the single crystal seed fiber. The feed rod and the single crystal feed fiber are moved at a predetermined speed to solidify the molten zone onto the seed fiber while simultaneously melting additional feed rod. In this manner a single crystal fiber is formed from the liquid portion.

Westfall, Leonard J.↗
NASA NTRS1973

Fatigue hardening in niobium single crystals.

Nb single crystals of various orientations were cyclically deformed in tension-compression under strain control. At low strain amplitudes all crystals oriented for single slip and some oriented for multiple slip showed a two stage hardening. When present, the first stage was characterized with almost no cyclic work hardening. The rate of hardening in the second stage increased with strain amplitude and the amount of secondary slip. In crystals oriented for single slip kink bands developed on their side faces during rapid hardening stage which resulted in considerable amount of asterism in Laue spots. A cyclic stress-strain curve independent of prior history was found to exist which was also independent of crystal orientation. Furthermore, this curve differed only slightly from that of polycrystalline Nb obtained from data in literature.

Doner, M.↗
NASA NTRS1974

Single Crystal Membranes

Single crystal a- and c-axis tubes and ribbons of sodium beta-alumina and sodium magnesium beta-alumina were grown from sodium oxide rich melts. Additional experiments grew ribbon crystals containing sodium magnesium beta, beta double prime, beta triple prime, and beta quadruple prime. A high pressure crystal growth chamber, sodium oxide rich melts, and iridium for all surfaces in contact with the melt were combined with the edge-defined, film-fed growth technique to grow the single crystal beta-alumina tubes and ribbons. The crystals were characterized using metallographic and X-ray diffraction techniques, and wet chemical analysis was used to determine the sodium, magnesium, and aluminum content of the grown crystals.

Stormont, R. W.↗
DOE OSTI2025

Low fractional volume superconductivity in single crystals of Pr{sub 4}Ni{sub 3}O{sub 10} under pressure

Magnetotransport measurements of P⁢r4⁢N⁢i3⁢O10 single crystals performed under externally applied pressures up to 73 GPa in diamond anvil cells with either KBr or Nujol oil as pressure media yield signatures of superconductivity with a maximum onset temperature of approximately 31 K. True zero resistance was not observed, consistent with a nonpercolating superconducting volume fraction. Magnetization measurements provided corroborating evidence of superconductivity, with a pressure-dependent diamagnetic signal occurring below the onset temperature, and an estimate from the absolute value of the susceptibility suggests a superconducting volume fraction on the order of 10%. We observe sample to sample variations in the magnitude and pressure dependence of 𝑇𝑐 as well as a dependence on the configuration of electrical contacts on a given sample. Possible causes of this behavior may be significant inhomogeneities in the pressure and/or damage to the samples induced by the pressure media as well as inhomogeneities in the crystals themselves. The results imply that our as-grown P⁢r4⁢N⁢i3⁢O10 single crystals are not bulk superconductors but that there is a minority structure present within the crystals that is indeed superconductin

Chen, Xinglong↗
NASA NTRS1992

Vapor crystal growth studies of single crystals of mercuric iodide (3-IML-1)

A single crystal of mercuric iodide (HgI2) will be grown during the International Microgravity Lab. (IML-1) mission. The crystal growth process takes place by sublimation of HgI2 from an aggregate of purified material, transport of the molecules in the vapor from the source to the crystal, and condensation on the crystal surface. The objectives of the experiment are as follow: to grow a high quality crystal of HgI2 of sufficient size so that its properties can be extensively analyzed; and to study the vapor transport process, specifically the rate of diffusion transport at greatly reduced gravity where convection is minimized.

Vandenberg, Lodewijk↗
NASA NTRS1989

Fatigue behavior of a single-crystal superalloy

A single-crystal superalloy, PWA 1480 is under consideration as a replacement material for the turbine blades of the high pressure fuel turbopump (HPFTP) of the space shuttle main engine (SSME). Three separate experimental programs were conducted to characterize the fatigue behavior of this alloy. Fatigue tests were conducted at room temperature (in air) and at 1000 F (in vacuum) on smooth specimens machined from both cast bars and slabs. The data from all of these programs are consolidated to provide a broader characterization of the fatigue behavior of the single crystal PWA 1480. The zero-mean-stress fatigue relationships are expressed in terms of stress range versus cyclic life lines on log-log plots. Characterization of the fatigue behavior of (001) oriented PWA 1480 single crystal under conditions of tensile mean stress was performed by using the unified approach proposed by Heidmann. In this approach the fatigue life is modified by a mean stress parameter so that a single life relationship can be used to represent both zero and tensile mean stress data.

Kalluri, Sreeramesh↗
NASA NTRS1988

Unified constitutive model for single crystal deformation behavior with applications

Single crystal materials are being used in gas turbine airfoils and are candidates for other hot section components because of their increased temperature capabilities and resistance to thermal fatigue. Development of a constitutive model which assesses the inelastic behavior of these materials has been studied in 2 NASA programs: Life Prediction and Constitutive Models for Engine Hot Section Anisotropic Materials and Biaxial Constitutive Equation Development for Single Crystals. The model has been fit to a large body of constitutive data for single crystal PWA 1480 material. The model uses a unified approach for computing total inelastic strains (creep plus plasticity) on crystallographic slip systems reproducing observed directional and strain rate effects as a natural consequence of the summed slip system quantities. The model includes several of the effects that have been reported to influence deformation in single crystal materials, such as shear stress, latent hardening, and cross slip. The model is operational in a commercial Finite Element code and is being installed in a Boundary Element Method code.

Walker, K. P.↗
NASA NTRS1976

Rolling-contact deformation of MgO single crystals

Magnesium oxide single crystals were used as a model bearing material and deformed by rolling contact with a steel ball 0.64 cm in diameter. A dependence of depth of slip on rolling velocity which persisted with increasing numbers of rolling-contact cycles was discovered. The track width, track hardness and dislocation interactions as observed by transmission electron microscopy all increased in a consistent manner with increasing cycles. The rolling-contact state of stress produces a high density of dislocations in a localized zone. Dislocation interaction in this zone produces cleavage-type cracks after a large number of rolling-contact cycles. The orientation of the crystal influences the character of dislocation accumulation.

Dufrane, K. F.↗
NASA NTRS1981

Electrical switching in cadmium boracite single crystals

Cadmium boracite single crystals at high temperatures ( 300 C) were found to exhibit a reversible electric field-induced transition between a highly insulative and a conductive state. The switching threshold is smaller than a few volts for an electrode spacing of a few tenth of a millimeter corresponding to an electric field of 100 to 1000 V/cm. This is much smaller than the dielectric break-down field for an insulator such as boracite. The insulative state reappears after voltage removal. A pulse technique revealed two different types of switching. Unstable switching occurs when the pulse voltage slightly exceeds the switching threshold and is characterized by a pre-switching delay and also a residual current after voltage pulse removal. A stable type of switching occurs when the voltage becomes sufficiently high. Possible device applications of this switching phenomenon are discussed.

Takahashi, T.↗