Kohei Yoshimoto, Shuhei Takasu, Motoi Ueda, Atsunobu Masuno and Hiroyuki Inoue
589
La2O3–TiO2 (LT)-based glasses are promising materials for a wide range of optical applications because of their exceptionally high refractive indices and relatively low optical absorption in the visible wavelength range. In this study, LT-based multicomponent glasses were developed using the aerodynamic levitation technique, and their thermal stability, refractive index dispersion, and optical transmittance spectra were comprehensively analyzed. The addition of ZrO2 and SiO2 significantly improved the thermal stability of the glasses against crystallization. This enabled the fabrication of samples having diameters up to 25 mm, which is substantially larger than the typical glass size (approximately 2–3 mm) that is achievable through containerless processing. The LT-based glasses exhibited refractive indices at 2.161–2.315 at 587.562 nm, along with excellent transmittance characteristics relative to those of general optical glasses. An analysis of the refractive index dispersion based on the Lorentz model revealed that the densely packed structures and high electronic polarizabilities of oxygen atoms are critical factors in achieving ultra-high refractive indices and superior transmittance characteristics. Prototype lenses and wafer-shaped optical elements were fabricated using a glass molding press to demonstrate the potential of LT-based glasses for use in practical applications.
Yudai Inada, Naoki Tarutani, Miki Asanome, Sota Shimizu, Yasuaki Tokudome, Hiroki Yamada, Toshiaki Ina, Seiya Shimono, Kiyofumi Katagiri and Kei Inumaru
596
We report a cross-linker-free 3D printing strategy for fabricating hierarchically porous nickel-cobalt oxide objects using highly concentrated dispersions of metal hydroxide acrylate nanoparticles. By employing an optimized photoinitiator, millimetre-scale nanoparticle-based structures were successfully printed without the need for cross-linking agents. Upon thermal treatment under inert atmosphere, the printed objects transformed into Co–Ni alloy/carbon nanocomposites via intermediate carbide phases. Subsequent oxidation removed carbon domains and produced porous metal oxide architectures with tuneable meso- to macroporosity, while preserving the original printed shapes. This solid–solid phase separation process enabled pore formation without sacrificial templates or collapse of structure. Our approach offers a streamlined route to functional ceramic frameworks, with potential applications in catalysis, energy storage, and separations.
Samuel Eka Putra Payong Masan, Thanh Ngoc Pham, Kurt Irvin Medina Rojas, Beatriz Andrea Choi Tan, Febdian Rusydi, Yuji Hamamoto and Yoshitada Morikawa
602
Efficient global optimization is crucial in resource-intensive computations, such as atomistic structure search using density functional theory (DFT) calculations. This has been accomplished by combining the DFT with Gaussian process regression within a genetic algorithm called GOFEE. In this work, we modified the GOFEE algorithm to increase its efficiency. We introduced the scaled lower confidence bound acquisition function, which balances the surrogate energy and uncertainty to improve the atomic structure exploration. We implemented similarity-based structure sharing between independent GOFEE calculations to avoid redundant calculations in the target potential. We applied our modifications to find the global minimum in two-dimensional Himmelblau’s function, various hydrocarbon molecules, C60, TiO2 anatase surface reconstructions, and bulk Co-doped TiO2 anatase (Co@TiO2). While our modifications successfully increased the success rate in finding the global minimum of the former systems, they failed to find the ferromagnetic structure of Co@TiO2, as observed in experiments.
Yuichi Kobayashi, Masatomo Hattori, Hideaki Okano, Chifuyu Tanaka and Jun’ichi Kawano
610
Five types of three-component crystals have been reported in the BaO–CuO–SiO2 system. Among them, BaCuSi2O7 (Colinowensite, Han Purple), BaCuSi4O10 (Effenbergerite, Han Blue), and BaCu2Si2O7 (Scottyite, Dark Blue) have been known as blue/purple pigments since ancient times. Although there have been detailed reports on the structure and optical properties of these crystals in the visible region, there are no reports on their optical properties in the near-infrared region. In this study, these crystals were synthesized by heat treatment of BaCO3, CuO, and SiO2 mixtures at 900–1050 °C, and their visible and near-infrared reflectance was examined. It was found that three crystals exhibit an inherent blue or violet color and brightness, and all three crystals have extremely high near-infrared reflectance. Painted samples show brightness L* of 34–42, near-infrared reflectance of 62–67 %, and solar reflectance of 36–43 %, indicating its potential application as a blue/purple cool-roof paint. These pigments are extremely promising as infrared selective reflective blue/purple pigments needed for heat island measures.
Hiromichi Takebe, Nobuyasu Nishioka, Kohei Owaku and Katsuhiko Hatakeyama
618
Na2O–MgO–SiO2 glasses were evaluated as a matrix of alkali waste solidification in the plutonium-uranium redox extraction (PUREX) process. Effects of ZnO, Al2O3, and B2O3 additions in small concentrations (≤4 mol %) on thermal stability against crystallization at high temperatures and water durability were studied. Infrared spectroscopy was used to evaluate the network structures of the Si–O and B–O bonds. Melt viscosity was measured by an inner rotation method in the temperature range between 1100 and 1300 °C. The results revealed that the addition of B2O3 and ZnO significantly contributed to respective enhancements of the thermal stability and water durability of silicate glasses with moderate melt viscosities at the operating temperatures of the glass solidification method for nuclear waste.
Runa Miyata, Ryota Kobayashi, Satofumi Maruyama and Ai Momozawa
622
AlN ceramics with small grain sizes were fabricated by spark plasma sintering (SPS) using Y2O3 as the sintering aid. The thermal conductivity of the ceramics increased with rising sintering temperature; the specimen sintered at 1850 °C exhibited a thermal conductivity of 163 W m−1 K−1, comparable to that of ceramics produced by pressureless sintering at the same temperature. The amount of oxygen dissolved in AlN was estimated from the lattice parameter c, and its relation with thermal resistivity was analyzed by Slack’s plot. A higher sintering temperature enhanced the trapping effect of the sintering aid and reduced the oxygen content in the solid solution. In addition, SPS-prepared samples showed higher bending strength than those obtained by pressureless sintering (PLS). These findings demonstrate that the combined use of SPS and sintering aids suppresses grain growth and lowers the dissolved-oxygen level, resulting in AlN ceramics with both high thermal conductivity and bending strength.
Akira Hosono, Atsuki Sawa, Takashi Endo and Takahiro Yamada
626
Tantalum borides have conventionally been produced via high-temperature solid-state reactions of the corresponding elemental raw materials. In this study, a unique chemical reaction design to add SiO2 to the starting materials for an assist of TaB2 formation is demonstrated. Powder mixtures of Ta2O5, B2O3, and SiO2 were heated together with Na metal. TaB2 was formed with concurrent generation of Na2SiO3 (otherwise known as water glass) in the reaction. Nearly single phase of TaB2 powders with 50–200 nm particle sizes were obtained by by heating at a temperature range from 800 to 1000 °C followed by the successive removal of unreacted sodium and washing with ethanol and water. TaB2 grains having a hexagonal prism morphology and sizes of several micrometers were grown in the sample heated at 1100 °C, possibly because molten Na2SiO3 with a melting point of 1088 °C acted as a flux.
Kohei Hosoki, Akiko Obata and Toshihiro Kasuga
630
Composite particles consisting of aragonite and hydroxy-carbonate apatite (HCA) were developed using strontium-containing aragonite [(Ca,Sr)CO3] as the precursor via a phosphate-solution reaction under controlled conditions. An HCA layer with an approximate thickness of 1 µm was uniformly formed on the surfaces of the (Ca,Sr)CO3 particles. The formation of this HCA layer was achieved using (Ca,Sr)CO3; the introduction of Sr into aragonite, along with the adjustment of the phosphate solution’s pH and temperature, contributed to the moderate dissolution of aragonite. The gradual release of Ca2+ and Sr2+ ions from the particles, followed by their rapid reaction with phosphate ions in the solution, resulted in the formation of HCA on the particle surfaces.
A10-1
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