Understanding carbon contamination in the proton-conducting zirconates and cerates
We use first-principles calculations to explain why, among proton conductors, cerates are more susceptible to carbon degradation than zirconates.
08 HYDROGEN↗
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Water uptake and energetics of the formation of barium zirconate based multicomponent oxides
A group of multi-component oxides based on BaZrO 3 have been prepared using a solid-state reaction method and examined in terms of their water uptake and thermodynamics of formation. Depending on the type and amount of acceptor substitution, the synthesized compounds exhibit various proton defect concentrations, reaching up to 0.2 mol/mol for a compound containing 10 different elements in the B-sublattice, where 50% of them are acceptors. Further, for the most promising materials, van’t Hoff plots were created and the enthalpies and entropies of hydration were calculated. At higher temperatures, these parameters do not differ from the values for the reference yttrium doped barium zirconate. However, at lower temperatures they are more negative, indicating a more exothermic process of proton incorporation.
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
Thermoelectric and electrical properties of triple-conducting multicomponent oxides based on substituted barium cerate-zirconate
The study explores multicomponent oxides based on substituted barium cerate-zirconate perovskites synthesized by a solid-state reaction. The structure, microstructure, charge transport and thermoelectric properties are presented with a discussion.
Czudec, M. M. [Institute of Nanotechnology and Mat↗
Thermal transport in phase-stabilized lithium zirconate phosphates
The thermal properties of yttrium-stabilized lithium zirconate phosphate [LZP: Li 1+x+y Y x Zr 2-x (PO 4 ) 3 with x = 0.15, -0.2 ≤ y ≤ 0.4 and with x = 0.0, y = 0.0] are presented over a wide temperature range from 30 to 973 K, elucidating the interplay between structural phase transformations and thermal properties in a solid state superionic conducting material. At room temperature, the thermal conductivity decreases by more than 75% as the stoichiometry is changed from lithium deficient to excess and increases with increasing temperature, indicative of defect-mediated transport in the spark plasma sintered materials. The phase transformations and their stabilities are examined by x-ray diffraction and differential scanning calorimetry and indicate that the Y3 + substitution of Zr 4+ is effective in stabilizing the ionically conductive rhombohedral phase over the entire temperature range measured, the mechanism of which is found through ab initio theoretical calculations. Finally, these insights into thermal transport of LZP superionic conductors are valuable as they may be generally applicable for predicting material stability and thermal management in the ceramic electrolyte of future all-solid-state-battery devices.
36 MATERIALS SCIENCE↗
Influence of doping and thickness on domain avalanches in lead zirconate titanate thin films
In undoped lead zirconate titanate films of 1–2 μm thick, domain walls move in clusters with a correlation length of approximately 0.5–2 μm. Band excitation piezoresponse force microscopy mapping of the piezoelectric nonlinearity revealed that niobium (Nb) doping increases the average concentration or mobility of domain walls without changing the cluster area of correlated domain wall motion. In comparison, manganese (Mn) doping reduces the contribution of mobile domain walls to the dielectric and piezoelectric responses without changing the cluster area for correlated motion. In both Nb and Mn doped films, the cluster area increases and the cluster density drops as the film thickness increases from 250 to 1250 nm. This is evident in spatial maps generated from the analysis of irreversible to reversible ratios of the Rayleigh coefficients.
36 MATERIALS SCIENCE↗
Pyrochlore-type lanthanide titanates and zirconates: Synthesis, structural peculiarities, and properties
This contribution provides a thorough examination of the structural characteristics of pyrochlore-type lanthanide titanates and zirconates Ln2Ti2O7 and Ln2Zr2O7, across various length scales. This paper also examines their processing, interesting physical properties (electrical, magnetic, and thermal characteristics), and responses to high pressure and ion irradiation. Brief sections on the elemental oxides' crystal chemistry, pertinent phase diagrams, and energetics of defect formation are also provided. Pyrochlore-type Ln2Ti2O7 and Ln2Zr2O7 stand out as truly multifunctional materials. Moreover, they have emerged as fascinating materials due to magnetic geometrical frustration, arising from the ordering of magnetic Ln3+ and non-magnetic Ti4+ (or Zr4+) cations into separate, interpenetrating lattices of corner-sharing tetrahedra. This results in a diverse array of exotic magnetic ground states, such as spin-ice (e.g., Dy2Ti2O7 or Ho2Ti2O7) or quantum spin ice (e.g., Tb2Ti2O7), observed at both low and room temperatures. They also exhibit varied electrical and electrochemical characteristics. Some members such as Gd2Zr2O7, function as fast ion conductors with a conductivity (σ) of ≈10−2 S·cm−1 at 800 °C and activation energy (Ea) ranging from 0.85 to 1.52 eV, depending on the degree of structural disorder. Others, such as Gd2TiMoO7, are mixed ionic-electronic conductors with σ ≈ 25 S·cm−1 at 1000 °C, making them promising candidate materials for applications in energy conversion and storage devices and oxygen separation membranes. Their exceptionally low thermal conductivity (e.g., κ ∼ 1.1–1.7 W·m−1·K−1 between 700 and 1200 °C for Ln2Zr2O7), close to the glass-like lower limit of highly disordered solids, positions them as valuable materials for thermal barrier coatings. They can also effectively accommodate actinides (e.g., Pu, Np, Cm, Am) in solid solutions and sustain prolonged exposure to radiation due to alpha-decay events, while preserving the integrity of the periodic atomic structure. Proposed as major components in actinide-bearing ceramics, they contribute to the long-term immobilization and disposal of long-lived waste radionuclides from nuclear programs. Some of these properties are displayed simultaneously, opening avenues for new applications. Despite the wealth of data available in the literature, this review highlights the need for a better understanding of order/disorder processes in pyrochlore-type materials and the influence of the structural length scale on their physical and chemical properties. Recent experimental evidence has revealed that pyrochlore short-range structure is far more complex than originally thought. Moreover, pyrochlore local structure is now believed to include short-range, lower symmetry, ordered domains, such as the orthorhombic weberite-type of structure. Notably, short- and long-range structures appear decoupled across different length scales and temperature regimes, and these differences persist even in well-ordered samples. We believe that the pyrochlore structure offers a unique opportunity for examining the interplay between chemical composition, defect chemistry, and properties. In Memoriam: Rodney C. Ewing, Fondly Remembered.
Physics↗
Encapsulation and retention of 225 Ac, 223 Ra, 227 Th, and decay daughters in zircon-type gadolinium vanadate nanoparticles
Abstract Unwanted targeting of healthy organs caused by the relocation of radionuclides from the target site has been one of the limiting factors in the widespread application of targeted alpha therapy in patient regimens. GdVO 4 nanoparticles (NPs) were developed as platforms to encapsulate α -emitting radionuclides 223 Ra, 225 Ac, and 227 Th, and retain their decay daughters at the target site. Polycrystalline GdVO 4 NPs with different morphologies and a zircon-type tetragonal crystal structure were obtained by precipitation of GdCl 3 and Na 3 VO 4 in aqueous media at room temperature. The ability of GdVO 4 crystals to host multivalent ions was initially assessed using La, Cs, Bi, Ba, and Pb as surrogates of the radionuclides under investigation. A decrease in Ba encapsulation was obtained after increasing the concentration of surrogate ions, whereas the encapsulation of La cations in GdVO 4 NPs was quantitative (∼100%). Retention of radionuclides was assessed in vitro by dialyzing the radioactive GdVO 4 NPs against deionized water. While 227 Th was quantitatively encapsulated (100%), a partial encapsulation of 223 Ra (∼75%) and 225 Ac (>60%) was observed in GdVO 4 NPs. The maximum leakage of 221 Fr (1st decay daughter of 225 Ac) was 55.4 ± 3.6%, whereas for 223 Ra (1st decay daughter of 227 Th) the maximum leakage was 73.0 ± 4.0%. These results show the potential of GdVO 4 NPs as platforms of α -emitting radionuclides for their application in targeted alpha therapy.
62 RADIOLOGY AND NUCLEAR MEDICINE↗
Meteoritic zircon.
Zircon identified in Vaca Muerta meteoritic specimens by electron probe microanalysis
METEORITIC COMPOSITION↗
Zircon and chromite crystals in a Muong Nong- type tektite
Chromite, zircon and quartz crystals in Muong Nong type tektites by X ray diffraction, discussing possible impact origin
Glass, B. P.↗
Rare earth concentrations in zircons and apatites and their host dacites and granites
Rare earth element concentrations in zircons and apatites separated from dacites and granites, explaining partition coefficients between phenocrysts and groundmass by crystal structure
Nagasawa, H.↗
Oxidation behavior of nickel-chromium-aluminum-yttrium - Magnesium oxide and nickel-chromium-aluminum-yttrium - zirconate type of cermets
The 1100 and 1200 C cyclic oxidation resistance of dense Ni-Cr-Al-Y - MgO, Ni-Cr-Al-Y - CaZrO3, Ni-Cr-Al-Y - SrZrO3, Ni-Cr-Al-Y - MgZro3 cermets and a 70 percent dense Ni-Cr-Al-Y developmental material was determined. The cermets contained 60 and 50 volume percent of Ni-Cr-Al-Y which formed a matrix with the oxide particles imbedded in it. The cermets containing MgO were superior to cermets based on zirconates and to the porous Ni-Cr-Al-Y material.
Zaplatynsky, I.↗
Reactions of calcium orthosilicate and barium zirconate with oxides and sulfates of various elements
Calcium orthosilicate and barium zirconate were evaluated as the insulation layer of thermal barrier coatings for air cooled gas turbine components. Their reactions with various oxides and sulfates were studied at 1100 C and 1300 C for times ranging up to 400 and 200 hours, respectively. These oxides and sulfates represent potential impurities or additives in gas turbine fuels and in turbine combustion air, as well as elements of potential bond coat alloys. The phase compositions of the reaction products were determined by X-ray diffraction analysis. BaZrO3 and 2CaO-SiO2 both reacted with P2O5, V2O5, Cr2O3, Al2O3, and SiO2. In addition, 2CaO-SiO2 reacted with Na2O, BaO, MgO, and CoO and BaZrO3 reacted with Fe2O3.
Zaplatynsky, I.↗
Hot isostatic pressing of silicon nitride Sisub3n4 containing zircon, or zirconia and silica
A hydrothermal synthesis apparatus with a 10 KB cylinder was used to obtain a sintered body of silicon nitride. The sintering auxiliary agents used were zircon (ZrSiO4) and a mixture of zirconia (ZrO2) and silica (SiO2). Experiments were conducted with the amounts of ZrSi04 or ArO2 and SiO2 varying over a wide range and the results compared to discover the quantity of additive which produced sintering in silicon nitride by the hot pressing method.
Somiya, S.↗
Dating Archean zircon by ion microprobe: New light on an old problem
Ion microprobe analysis of zircons from three sites (Watersmeet Dome in northern Michigan, Mount Sones in eastern Antarctica, and Mount Narryer in western Australia) is discussed. Implications of the results to Archean geochronology and early Earth crust composition are addressed.
Williams, I. S.↗
Alpha-decay-induced fracturing in zircon - The transition from the crystalline to the metamict state
Zonation due to alpha-decay damage in a natural single crystal of zircon from Sri Lanka is discussed. The zones vary in thickness on a scale from one to hundreds of microns. The uranium and thorium concentrations vary from zone to zone such that the alpha decay dose is between 0.2 x 10 to the 16th and 0.8 x 10 to the 16th alpha-events per milligram. The transition from the crystalline to the aperiodic metamict state occurs over this dose range. At doses greater than 0.8 x 10 to the 16th alpha events/mg there is no evidence for long-range order. This type of damage will accumulate in actinide-bearing, ceramic nuclear waste forms. The systematic pattern of fractures would occur in crystalline phases that are zoned with respect to actinide radionuclides.
Chakoumakos, Bryan C.↗
Impact Shocking of a Zircon-Sanidine Mixture and Investigations of Pb Mobility
The purpose of this project is to explore the mobility, mixing, and possible clumping of Pb isotopes during laboratory impact shock experiments. Impact events are a common planetary occurrence and their effect on istotope systematics and subsequent geochronology is not fully understood. By artificially shocking mixtures of zircon and sanidine and investigating the sample products, it may be possible to understand if and how Pb is mobilized during impact shock. Isotopes of Pb are the final daughter products of the decay chains of 238U, 235U and 232Th and therefore understanding how mobile the daughter product is during impact events could have consequences for dating impact events. These investigations will also reveal if Pb isotopes can be mixed between minerals
Szumila, I.↗
Impact Shocking of a Zircon-Sanidine Mixture and Investigations of Pb Mobility
The purpose of this project is to explore the mobility, mixing, and possible clumping of Pb isotopes during laboratory impact shock experiments. Impact events are a common planetary occurrence and their effect on istotope systematics and subsequent geochronology is not fully understood. By artificially shocking mixtures of zircon and sanidine and investigating the sample products, it may be possible to understand if and how Pb is mobilized during impact shock. Isotopes of Pb are the final daughter products of the decay chains of 238U, 235U and 232Th and therefore understanding how mobile the daughter product is during impact events could have consequences for dating impact events. These investigations will also reveal if Pb isotopes can be mixed between minerals.
Szumila, I.↗
Methodologies for 176 Lu– 176 Hf Analysis of Zircon Grains from the Moon and Beyond
Not Available
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗