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Photoplastic effect in MgO single crystals MgO单晶的光塑性效应
4区 材料科学 Q3 Chemistry Pub Date : 2023-10-01 DOI: 10.2109/jcersj2.23060
Yu Ogura, Yuki Tsuchiya, Sena Hoshino, Tatsuya Yokoi, Katsuyuki Matsunaga
The photoplastic effect, phenomena that flow stress and/or hardness change by light illuminations, has been known mainly in II–VI compound semiconductors. In this study, it was revealed for the first time that magnesium oxide (MgO) single crystals exhibit increase in flow stress by light illumination, namely, the positive photoplastic effect. Scanning transmission electron microscope (STEM) observations demonstrated that the plastic deformation of MgO is realized by generation of glide dislocations on the slip system of {110}〈110〉. Therefore, the observed positive photoplastic effect of MgO is likely due to interactions of the glide dislocations and photo-excited carriers. According to the theoretical calculations, individual dislocations in MgO had a specific band structure that differs from the bulk. This also indicates possible interactions between dislocations and carriers. It is expected that light illumination can reduce dislocation mobility in MgO, leading to the increase in flow stress under light illuminations.
光塑性效应,即流动应力和/或硬度随光照变化的现象,主要是在II-VI化合物半导体中发现的。本研究首次揭示了氧化镁(MgO)单晶在光照下表现出流动应力的增加,即正光塑性效应。扫描透射电镜(STEM)观察表明,MgO的塑性变形是通过在{110}< 110 >滑移系上产生滑移位错实现的。因此,观察到的MgO的正光塑性效应可能是由于滑动位错和光激发载流子的相互作用。根据理论计算,MgO中的单个位错具有不同于体的特定能带结构。这也表明位错和载流子之间可能存在相互作用。预计光照可以降低MgO中的位错迁移率,从而导致光照下流动应力的增加。
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引用次数: 0
Time-reduction imaging method for scanning-probe microscopy using a compressed sensing algorithm based on sequential reconstruction method 基于序列重建方法的压缩感知扫描探针显微镜成像时间缩短方法
4区 材料科学 Q3 Chemistry Pub Date : 2023-10-01 DOI: 10.2109/jcersj2.23042
Keiichi Ueda, Diao Zhuo, Linfeng Hou, Hayato Yamashita, Masayuki Abe
The surface image measurement time was reduced by data completion using a compressed sensing algorithm in the image-acquisition of scanning probe microscopy. In particular, by reducing the number of acquisition points of the surface-roughness image and reconstructing the image using estimated values, acquiring the surface image at one-eighth of the data-measurement time became possible. The reduced measurement time was shown to reduce the influence of thermal drift during image capture. The real time surface image demonstrated that reconstruction is possible during surface image acquisition.
在扫描探针显微镜图像采集中,采用压缩感知算法进行数据补全,缩短了表面图像测量时间。特别是,通过减少表面粗糙度图像的采集点数量并使用估计值重建图像,可以在八分之一的数据测量时间内获取表面图像。缩短的测量时间可以减少图像捕获过程中热漂移的影响。实时表面图像表明,在表面图像采集过程中,重构是可能的。
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引用次数: 0
Synthesis and fluorescence properties of octacalcium phosphate with incorporated pyridinedicarboxylate ions 掺杂吡啶二羧酸盐离子的磷酸八钙的合成及其荧光性质
4区 材料科学 Q3 Chemistry Pub Date : 2023-10-01 DOI: 10.2109/jcersj2.23027
Taishi Yokoi, Masahiro Watanabe, Yuejun Wang, Tomoyo Goto, Tohru Sekino, Masaya Shimabukuro, Masakazu Kawashita
Octacalcium phosphate (OCP) has a layered structure and various carboxylate ions can be incorporated into its structure as interlayer ions. In recent studies, aromatic carboxylate ions have been incorporated into OCP to impart fluorescence properties. In such fluorescent OCP materials, the incorporated carboxylate ions can be regarded as ‘crystal defect cores’. Although fluorescent OCPs with incorporated benzenedicarboxylate ions have been reported, the synthesis and fluorescence of OCPs with incorporated pyridinedicarboxlate ions have not yet been investigated. In this study, our aim was to synthesise OCP with incorporated 2,5-pyridinedicarboxylate ions and evaluate its fluorescence behaviour. Samples were synthesised by reacting calcium carbonate and phosphoric acid in 2,5-pyridinedicarboxylic acid solution. When the 2,5-pyridinedicarboxylic acid concentration in the solution was low, plate-shaped crystals of OCP with incorporated 2,5-pyridinedicarboxylate ions were formed. As the 2,5-pyridinedicarboxylic acid concentration increased, OCP formation was suppressed, and a poorly soluble salt composed of calcium and 2,5-pyridinedicarboxylate ions was formed in its place. The (100) interplanar spacing of OCP was increased from 1.87 to 2.26 nm by the incorporation of 2,5-pyridinedicarboxylate ions as interlayer ions. The incorporation of 2,5-pyridinedicarboxylate ions was confirmed by Fourier-transform infrared spectroscopy. OCP with incorporated 2,5-pyridinedicarboxylate ions exhibited fluorescence with an emission wavelength of 430 nm upon excitation at 320 nm. The results of this study should prove useful for the design and development of fluorescent OCP materials.
磷酸八钙(OCP)具有层状结构,各种羧酸离子可作为层间离子掺入其结构中。在最近的研究中,芳香羧酸离子被纳入OCP以赋予荧光特性。在这种荧光OCP材料中,掺入的羧酸盐离子可视为“晶体缺陷核”。虽然已报道了掺入苯二羧酸盐离子的荧光ocp,但尚未对掺入吡啶二羧酸盐离子的ocp的合成和荧光进行研究。在这项研究中,我们的目的是合成含有2,5-吡啶二羧酸盐离子的OCP,并评估其荧光行为。在2,5-吡啶二羧酸溶液中,碳酸钙与磷酸反应合成样品。当溶液中2,5-吡啶二羧酸浓度较低时,加入2,5-吡啶二羧酸离子的OCP形成板状晶体。随着2,5-吡啶二羧酸浓度的增加,OCP的形成受到抑制,取而代之的是由钙和2,5-吡啶二羧酸盐离子组成的难溶盐。2,5-吡啶二羧酸盐离子的加入使OCP的(100)面间距从1.87 nm增加到2.26 nm。傅里叶变换红外光谱证实了2,5-吡啶二羧酸盐离子的掺入。在320 nm激发下,加入2,5-吡啶二羧酸盐离子的OCP显示出430 nm的荧光。本研究结果将为荧光OCP材料的设计和开发提供参考。
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引用次数: 1
Strain-rate insensitive photoindentation pop-in behavior in ZnS single crystals at room temperature 室温下ZnS单晶应变速率不敏感的光压痕弹出行为
4区 材料科学 Q3 Chemistry Pub Date : 2023-10-01 DOI: 10.2109/jcersj2.23064
Yan Li, Hiroto Oguri, Ayaka Matsubara, Eita Tochigi, Xufei Fang, Yu Ogura, Katsuyuki Matsunaga, Atsutomo Nakamura
The structural and mechanical reliability of inorganic semiconductors for practical applications is determined by the rate at which they can deform and sustain externally applied strain. In this research, nanoindentation experiments under three strain rates and two light conditions were performed on single-crystal ZnS with an 80 nm radius Berkovich tip at a peak load of 60 µN. Significant pop-in events were observed in all indentation tests. The calculated maximum resolved shear stress at the first pop-in approximated the theoretical strength of ZnS, indicating a homogeneous dislocation nucleation process. The cumulative spreads of the maximum shear stress were found to be insensitive to the strain rate, and the distribution at a small strain rate was slightly broader than that of the other two strain rates because of thermal noise. Calculated activation energy ΔG required for the dislocation nucleation indicates that dislocation nucleation in ZnS could occur with external stress and without much assistance of thermal energy, leading to weak dependence of the first pop-in on the strain rate. At three strain rates, light consistently showed little influence on the pop-in behavior and dislocation nucleation process.
无机半导体在实际应用中的结构和机械可靠性取决于其变形和承受外部施加应变的速度。在本研究中,在三种应变速率和两种光照条件下,对具有80 nm半径Berkovich尖端的单晶ZnS进行了纳米压痕实验,峰值负载为60µN。在所有缩进测试中都观察到显著的弹出事件。计算得到的第一次弹出时的最大分解剪应力与ZnS的理论强度接近,表明这是一个均匀的位错成核过程。最大剪切应力的累积分布对应变速率不敏感,由于热噪声的影响,小应变速率下的最大剪切应力累积分布比其他两种应变速率下的最大剪切应力累积分布略宽。计算得出位错形核所需的活化能ΔG表明,ZnS中的位错形核可以在外部应力作用下发生,而不需要太多的热能辅助,导致第一次弹出对应变速率的依赖性较弱。在三种应变速率下,光对弹入行为和位错成核过程的影响均较小。
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引用次数: 0
A guideline for searching for stable grain boundary structure by utilizing crystallographic information: A method based on non-identical termination 利用晶体学信息寻找稳定晶界结构的准则:一种基于非同终止的方法
4区 材料科学 Q3 Chemistry Pub Date : 2023-10-01 DOI: 10.2109/jcersj2.23019
Yuki Hata, Yaoshu Xie, Kiyou Shibata, Teruyasu Mizoguchi
Determining the stable atomic structure of grain boundaries (GBs) is one of the most important tasks for computational materials science to comprehensively understand the structure-property relationship of GBs in real polycrystalline materials. In this paper, we revisit a proposed method (PM) that was thought to be ineffective in determining the stable GB structures based on sampling non-identical terminating crystal planes of the two adjoining crystals forming the GB. In contrast to the previous conclusion, we found that the PM is effective regarding both the reproducibility of stable structures and calculation cost. This method could determine the most stable GB structures and energies of not only elemental materials of face-centered-cubic and body-centered-cubic metals, including Cu and Mo, but also a binary ceramic material, MgO. We show that the PM can greatly reduce the number of necessary candidate structures calculated to determine the stable GB structures compared with other brute-force methods sampling the rigid body translation between the two adjoining crystals. We demonstrated that sampling GB structures made of non-identical termination combinations is a useful and effective method to determine the stable GB structures of various materials.
确定晶界的稳定原子结构是全面了解实际多晶材料中晶界的结构-性能关系的计算材料科学的重要任务之一。在本文中,我们重新审视了一种被认为是无效的方法(PM),该方法基于采样形成GB的两个相邻晶体的不相同的终止晶体平面来确定稳定的GB结构。与之前的结论相比,我们发现PM在稳定结构的再现性和计算成本方面都是有效的。该方法不仅可以测定面心立方和体心立方金属元素材料Cu和Mo以及二元陶瓷材料MgO的最稳定的GB结构和能量。我们的研究表明,与其他暴力方法取样相邻晶体之间的刚体平移相比,PM可以大大减少确定稳定GB结构所需的候选结构的计算数量。我们证明了由不同端接组合组成的GB结构取样是测定各种材料的稳定GB结构的一种有用而有效的方法。
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引用次数: 0
Electrochemical and mechanical properties and chemical stability of Li<sub>10</sub>GeP<sub>2</sub>S<sub>12</sub>/Al<sub>2</sub>O<sub>3</sub> composite electrolytes Li&lt;sub&gt;10&lt;/sub&gt; ge&gt;2&lt;/sub&gt;S&lt;sub&gt;12&lt;/sub&gt;/Al&lt;sub&gt;2&lt;/sub&gt; 0&lt; sub&gt;3&lt;/sub&gt;复合电解质
4区 材料科学 Q3 Chemistry Pub Date : 2023-10-01 DOI: 10.2109/jcersj2.23070
Takumi Yabuzaki, Miho Sato, Hanseul Kim, Kenta Watanabe, Naoki Matsui, Kota Suzuki, Satoshi Hori, Kazuhiro Hikima, Satoshi Obokata, Hiroyuki Muto, Atsunori Matsuda, Ryoji Kanno, Masaaki Hirayama
Sulfide-type solid electrolytes for all-solid-state lithium-ion batteries are required to have high ionic conductivity, high (electro) chemical stability, and suitable mechanical properties. Compositing different materials is widely performed in developing multifunctional materials. However, only a few studies have investigated sulfide electrolytes due to the concern of lowering ionic conductivity. In this study, composite electrolytes comprising Li10GeP2S12 (LGPS)-type electrolytes and nanosized Al2O3 are fabricated by a solid-state reaction. Al2O3 particles are mainly located in the voids between LGPS particles, whereas very limited oxygen content is substituted for sulfur in the LGPS structure. LGPS–Al2O3 composites exhibit ionic conductivities of ∼5 mS cm−1 without significant changes by compositing Al2O3. LGPS–Al2O3 composites are softer and have higher atmospheric stability than uncomposed LGPS. All solid-state cells that use air-exposed LGPS–Al2O3 as a separator layer exhibit an improved cycle retention compared with that using air-exposed LGPS. These results demonstrate that electrolyte compositing is an effective means of improving other properties while maintaining high lithium ionic conductivity.
用于全固态锂离子电池的硫化物型固体电解质要求具有高离子电导率、高(电)化学稳定性和合适的机械性能。复合材料在多功能材料的开发中应用广泛。然而,由于担心降低离子电导率,对硫化物电解质的研究很少。本研究通过固相反应制备了由Li10GeP2S12 (LGPS)型电解质和纳米Al2O3组成的复合电解质。Al2O3颗粒主要分布在LGPS颗粒之间的空隙中,而在LGPS结构中,极有限的氧取代了硫。lgp - Al2O3复合材料的离子电导率为~ 5 mS cm−1,没有明显的变化。与未组成的LGPS相比,lgp - al2o3复合材料更柔软,具有更高的大气稳定性。与使用空气暴露的LGPS相比,所有使用空气暴露的lgp - al2o3作为分离层的固态电池都表现出更好的循环保持能力。这些结果表明,电解质复合是在保持高锂离子电导率的同时改善其他性能的有效手段。
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引用次数: 1
A more accurate method to measure the oxygen content in YBa<sub>2</sub>Cu<sub>3</sub>O<i><sub>y</sub></i> superconductors 一种更精确的测量YBa&lt;sub&gt;2& gt; /sub&gt; cu&gt;3&lt;/sub&gt; o&gt;i&gt; /sub&gt; y&gt;/sub&gt;超导体
4区 材料科学 Q3 Chemistry Pub Date : 2023-10-01 DOI: 10.2109/jcersj2.23108
Yuliang Wei, Shiro Kambe
The copper (Cu) valence greatly influences the transition temperature (Tc) in cuprate superconductors. According to the charge neutralization rule, the Cu valence is calculated from the oxygen content. Previously, we developed the dissolved oxygen (DO) method as a novel oxygen measurement method for La2−xSrxCuO4 and YBa2Cu3Oy (YBCO) using a new DO sensor. The measurement time of the DO method is about one-third that of the standard iodometric method, but the difference in the measured Cu valence for YBCO is 0.039. Herein we report that a more accurate method, which combines the dissolved chlorine method and the corrected DO method, improves this difference to 0.013.
铜(Cu)的价态对铜超导体的转变温度(Tc)影响很大。根据电荷中和规则,由氧含量计算出铜价。在此之前,我们开发了溶解氧(DO)方法,作为一种新的氧测量方法,用于La2−xSrxCuO4和YBa2Cu3Oy (YBCO)。DO法的测量时间约为标准碘量法的三分之一,但YBCO的Cu价差为0.039。本文报道了一种更精确的方法,即结合溶解氯法和校正DO法,将这一差异提高到0.013。
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引用次数: 0
Tensile strength of a transverse grain boundary in a single-walled carbon nanotube 单壁碳纳米管横向晶界的抗拉强度
4区 材料科学 Q3 Chemistry Pub Date : 2023-10-01 DOI: 10.2109/jcersj2.23062
Yaoshu Xie, Kiyou Shibata, Teruyasu Mizoguchi
Adding carbon nanotubes (CNTs) into ceramics is an important way to promote toughness. Crystalline defects existing in materials play a significant role in affecting both their mechanical and functional performances because they bring symmetry breaking of the periodic lattice structures. For CNTs existing in real ceramic materials, which almost appear as polycrystalline forms, the most notable defects are the grain boundaries (GBs) which consist of defect cores of dislocations. It is of engineering importance to investigate the effects of these defect cores of GBs on the strength of the polycrystalline CNTs to promote the composites’ performances. The variety of grain orientations of the polycrystalline CNTs allows the GBs to have various misorientations and different arrangements of the defect cores of dislocations at the GBs, which causes disparity in the stress fields near the GBs under an external stress condition, thus making distinguishable effects on the strength. While effective rules have been established for graphene (GP) GBs to predict the tensile strengths of GP GBs with different misorientations, the effects of misorientation and curvature on the strength of CNT GBs have yet to be reported. This work studied these effects by molecular dynamics (MD) simulation. The results illustrate that the misorientation and temperature have much more significant effects than the curvature on the strength of CNT GBs, and verified a consistent tendency of the misorientation-strength relationship of the CNT GBs with the corresponding GP GBs. The CNT GBs and their corresponding GP GBs have almost identical strengths for most of the simulated results. Notable differences between CNT and GP GBs were only found at misorientations near 0 and 30° in armchair GBs. These strength differences were attributed to the crack stabilization and structural reconstruction in CNT GBs.
在陶瓷中加入碳纳米管(CNTs)是提高陶瓷韧性的重要途径。材料中存在的晶体缺陷会导致周期性晶格结构的对称性破坏,从而对材料的力学性能和功能性能产生重要影响。真实陶瓷材料中的碳纳米管几乎以多晶形式存在,其中最显著的缺陷是由位错缺陷核组成的晶界缺陷。研究这些缺陷核对多晶碳纳米管强度的影响,对提高复合材料的性能具有重要的工程意义。由于多晶CNTs晶粒取向的多样性,使得石墨烯中位错缺陷核在石墨烯中具有不同的取向偏差和不同的排列方式,从而导致在外加应力条件下石墨烯附近应力场的差异,从而对强度产生不同的影响。虽然已经为石墨烯(GP) gb建立了有效的规则来预测不同取向的GP gb的拉伸强度,但取向错误和曲率对碳纳米管gb强度的影响尚未报道。本文采用分子动力学(MD)模拟方法研究了这些效应。结果表明,错取向和温度对碳纳米管GBs强度的影响远大于曲率,验证了碳纳米管GBs的错取向-强度关系与相应的GP GBs具有一致的趋势。在大多数模拟结果中,碳纳米管GBs及其相应的GP GBs具有几乎相同的强度。碳纳米管和GP GBs之间的显著差异仅在扶手椅GBs的0°和30°附近发现。这些强度差异归因于碳纳米管gb中的裂纹稳定和结构重建。
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引用次数: 0
Call for a Guest Editor for a Special Issue 邀请特刊的客座编辑
4区 材料科学 Q3 Chemistry Pub Date : 2023-10-01 DOI: 10.2109/jcersj2.131.a10-1
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引用次数: 0
Synthesis of garnet-type Mn<sup>4+</sup>-activated Y<sub>3</sub>(Al,Ga)<sub>5</sub>O<sub>12</sub> and (Y,Gd)<sub>3</sub>Al<sub>5</sub>O<sub>12</sub> phosphors with controlled emission by cation substitution 石榴石型Mn&lt;sup&gt;4+&lt;/sup&gt;-活化Y&lt;sub&gt;3&lt;/sub&gt;(Al,Ga)&lt;sub&gt;5&lt;/sub&gt; 0 &lt;sub&gt;12&lt;/sub&gt;和(Y, Gd) & lt; sub&gt; 3 & lt; / sub&gt; Al&lt; sub&gt; 5 & lt; / sub&gt; O&lt; sub&gt; 12 & lt; / sub&gt;用阳离子取代控制发光的荧光粉
4区 材料科学 Q3 Chemistry Pub Date : 2023-10-01 DOI: 10.2109/jcersj2.23063
Takuya Sasaki, Ryota Asaka, Ken Niwa, Nico Alexander Gaida, Masashi Hasegawa
Ga- and Gd-substituted garnet-type Y3Al5O12:Mn4+ phosphors, Y3(Al1−xGax)5O12:Mn4+ and (Y1−yGdy)3Al5O12:Mn4+, were synthesized by a conventional solid-state reaction to elucidate the relationship between the emission and the local structure of the activator in the host material. Completely substituted Y3(Al1−xGax)5O12 and ∼80 % substituted (Y1−yGdy)3Al5O12 (y ≤ ∼0.8) solid solutions have been produced. The lattice parameters of the garnet-type solid solutions increased linearly with the substitution of Ga and Gd for Al and Y sites, respectively. The emission peak attributed to the Mn4+ luminescence center of their garnet-type solid solutions shifted toward a longer wavelength side by substituting Ga and Gd. The emission peak wavelength of the Mn4+-activated garnet-type solid solutions increased almost linearly with increasing the average bond length between the cation and anion in the dodecahedral sites. The dodecahedral site in the garnet structure is edge-sharing with the octahedral site where Mn4+ exists. These results indicate that the emission wavelength can be controlled by changing the local structure around Mn4+ due to the cation substitution of coordination polyhedra neighboring Mn4+ coordination polyhedra.
采用常规固相反应合成了Ga-和gd -取代石榴石型Y3Al5O12:Mn4+荧光粉Y3(Al1−xGax)5O12:Mn4+和(Y1−yGdy)3Al5O12:Mn4+,以阐明激发剂在主体材料中的局部结构与发光的关系。制备了完全取代的Y3(Al1−xGax) 5012和~ 80%取代的(Y1−yGdy) 3al5012 (y≤~ 0.8)固溶体。石榴石型固溶体的晶格参数随Ga和Gd分别取代Al和Y位而线性增加。它们的石榴石型固溶体的Mn4+发光中心在取代了Ga和Gd后,发射峰向波长较长的一侧偏移。Mn4+活化的石榴石型固溶体的发射峰波长随着十二面体正离子和阴离子之间的平均键长的增加几乎呈线性增加。石榴石结构中的十二面体位点与Mn4+存在的八面体位点共用边。这些结果表明,由于邻近的Mn4+配位多面体的阳离子取代,可以通过改变Mn4+周围的局部结构来控制发射波长。
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引用次数: 0
期刊
Journal of the Ceramic Society of Japan
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