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One Step Synthesis of Lead Zirconate Titanate Ceramic Using a Solid State Reaction Method 固相反应法一步合成锆钛酸铅陶瓷
Pub Date : 2021-01-01 DOI: 10.2139/ssrn.3874492
Darmawan Hidayat, Mohammad Taufik, S. Setianto
Lead zirconate titanate PbZr(1-x)TixO3 (PZT) particles were synthesized at x of 0.48 using a solid-state reaction (SSR) method at various operating temperatures of 700 – 1000 °C. Prior to the solid-state reaction in a muffle furnace, the precursor powder was shaker milled for two hours. The structural analysis of the particles diffraction patterns reveals the formation of perovskite structure of PZT particles and the coexistence of tetragonal and rombhohedral phase at the samples synthesized at temperatures of 800 and 900 °C. The crystallite size of particles synthesized at 1000 °C and commercial were 36.00 and 47.98 nm, respectively. The synthesized particles were non-spherical and showed the formation of bimodal particle size distribution with sizes of 5 – 20 μm. In conclusion, PZT particles have been successfully synthesized via a one-step synthesis using SSR method with a pre-mixed shaker milling.
采用固态反应(SSR)方法,在700 ~ 1000℃的工作温度下,在x = 0.48的温度下合成了锆钛酸铅PbZr(1-x)TixO3 (PZT)颗粒。在马弗炉中进行固态反应之前,前驱体粉末经过振动筛研磨两小时。在800℃和900℃温度下合成的PZT颗粒衍射图表明,PZT颗粒形成钙钛矿结构,四方相和方面体相并存。在1000℃下合成的颗粒晶粒尺寸分别为36.00 nm和47.98 nm。合成的颗粒呈非球形,粒径分布为5 ~ 20 μm的双峰型。综上所述,采用SSR法一步合成了PZT颗粒。
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引用次数: 0
Preparation, Characterization and Antiproliferation Evaluation of Nanoliposome Loaded with Anthocyanins 载花青素纳米脂质体的制备、表征及抗增殖评价
Pub Date : 2021-01-01 DOI: 10.2139/ssrn.3931686
Rui Zhang, Wei Liu, L. Kong, Qian Zhang, Shuxin Ye, Sijia Jiang, Jingren He, Muci Wu
This study aimed to investigate the nanoliposomes composed of soy lecithin and cholesterol for encapsulation of anthocyanins (ACNs) by thin film ultrasonic dispersion method. The processing conditions of ACNs nanoliposomes (ANLs) were optimized, and the ANLs were characterized by average particle size, zeta (ζ)-potential and polydispersity index (PDI). Their storage stability under various pH, temperature, light conditions, and in vitro antiproliferative effect were analyzed. The optimal preparation parameters were suggested to be soy lecithin to cholesterol ratio of 80 mg to 19 mg (w/w, 2 mg of ACNs) by using ultrasonication at 120 W for 3.12 min. The produced ANLs had the encapsulation efficiency of 40.1 % with average particle size of 117 nm, PDI of 0.254 and ζ-potential of 8.56 mV. These ANLs presenting ≈ 130 nm of stable sizes at tested pH conditions. The ACNs showed better in vitro antiproliferative effect for two cancer cell lines than ANLs, while ANLs were more stable against temperature and light. The ACNs in nanoliposomes displayed higher retention efficiency than that of in solution under various storage conditions. This study provides a promising approach for stabilizing ACNs-containing food ingredients, which displays large potentiality in the productions of nutraceutical and functional foods.
以大豆卵磷脂和胆固醇组成的纳米脂质体为原料,采用超声薄膜分散法研究其对花青素的包封作用。优化了ACNs纳米脂质体(ANLs)的制备工艺,并用平均粒径、ζ (ζ)电位和多分散性指数(PDI)对ANLs进行了表征。分析了其在不同pH、温度、光照条件下的贮藏稳定性及体外抗增殖作用。最佳制备工艺参数为大豆卵磷脂/胆固醇比为80 mg / 19 mg (w/w, acn为2 mg),超声功率为120 w,反应时间为3.12 min。所得ANLs包封率为40.1%,平均粒径为117 nm, PDI为0.254,ζ电位为8.56 mV。这些anl在测试的pH条件下呈现出≈130 nm的稳定尺寸。acn对两种肿瘤细胞系的体外抗增殖作用均优于anl,而anl对温度和光照的稳定性更强。在不同的储存条件下,纳米脂质体中acn的保留效率均高于溶液中。本研究为稳定含acns的食品成分提供了一种很有前景的方法,在营养保健和功能食品的生产中具有很大的潜力。
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引用次数: 0
Anionic LaH - 8: A Nanocluster-Based Hydrogen Storage Material 阴离子LaH - 8:纳米簇基储氢材料
Pub Date : 2021-01-01 DOI: 10.2139/ssrn.3878347
Hai Yan Wang, Shouyuan Huang, Simin Li, Guangli Zhang, Yuan Su, Cheng Lu
The geometric structures of anionic LaH-n (n=2-20) clusters are predicted by CALYPSO cluster structural search method and first-principles calculations. The low-lying isomers for each size of LaH-n (n=2-20) clusters are further reoptimized at B3LYP level by setting all-electron 6-311G++(d, p) basis set for H atoms and SDD basis set for La atom, respectively. The photoelectron spectroscopy (PES) of the ground-state structures are simulated by time-dependent DFT (TD-DFT) method. It is found that the anionic LaH-8 cluster with D2d symmetry is the most stable structure and its hydrogen storage capacity arrives at 5.4 wt%. The stability of anionic LaH-8 cluster is mainly affected by the strong interaction between H 1s orbital and La 5d orbital. The present results provide insights into the further exploration and discovery of novel rare-earth based hydrogen storage nanomaterials.
利用CALYPSO簇结构搜索方法和第一性原理计算预测了阴离子la -n (n=2-20)簇的几何结构。通过对H原子和La原子分别设置全电子6- 311g++ (d, p)基和SDD基,进一步在B3LYP水平上对不同尺寸的LaH-n (n=2-20)簇的低洼异构体进行优化。利用时变DFT (TD-DFT)方法模拟了基态结构的光电子能谱(PES)。结果表明,D2d对称的阴离子la -8簇是最稳定的结构,其储氢容量达到5.4 wt%。阴离子LaH-8簇的稳定性主要受h1s轨道与la5d轨道强相互作用的影响。本研究结果为进一步探索和发现新型稀土基储氢纳米材料提供了见解。
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引用次数: 0
Tuning Thermal Expansion From Strong Negative to Zero to Positive in Cu 2-xZn xP 2O 7 Solid Solutions 在cu2 - xzn xP 2O - 7固溶体中调整热膨胀从强负到零到正
Pub Date : 2021-01-01 DOI: 10.2139/ssrn.3854490
Naike Shi, A. Sanson, Alessandro Venier, Longlong Fan, Yang Ren, Danilo Oliveira de Souza, L. Olivi, Yuzhu Song, X. Xing, Jun Chen
Chemical substitution is an effective method to control the thermal expansion properties in solid solutions. In this work, a series of solid solutions Cu2-xZnxP2O7(0 ≤ x ≤ 2) were synthesized by solid state methods. The thermal expansion in Cu2-xZnxP2O7 is tuned from strong negative thermal expansion (αv ~ -33.5×10-6 K-1, 100 - 375K) to near zero thermal expansion (αv ~ -2.78×10-6 K-1, 100 - 225K), and then to positive thermal expansion gradually with increasing content of Zn2+ substitution. The direct experiment results reveal that the Zn2+ substitution diminishes the rigidity of Cu/Zn-O and P-O bonds and the transverse vibrations of O atoms arousing negative thermal expansion. The present work realizes the control of thermal expansion from negative to near zero, and then to positive in the Cu2P2O7 system.
化学取代是控制固溶体热膨胀性能的有效方法。本文采用固相法合成了一系列Cu2-xZnxP2O7(0≤x≤2)固溶体。随着Zn2+取代物含量的增加,Cu2-xZnxP2O7中的热膨胀由强烈的负热膨胀(αv ~ -33.5×10-6 k - 1,100 - 375K)转变为接近零的热膨胀(αv ~ -2.78×10-6 k - 1,100 - 225K),然后逐渐转变为正热膨胀。直接实验结果表明,Zn2+取代降低了Cu/Zn-O和P-O键的刚性,并引起O原子的横向振动引起负热膨胀。本工作实现了在Cu2P2O7体系中由负到近零再到正的热膨胀控制。
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引用次数: 1
Enhancement of Electrocatalytic Hydrogen Evolution by Topological Engineering in Hybrid Weyl Catalyst NiSi 基于拓扑工程的混合Weyl催化剂NiSi电催化析氢研究
Pub Date : 2021-01-01 DOI: 10.2139/ssrn.3919944
Wei Liu, Xiaoming Zhang, W. Meng, Y. Liu, X. Dai, Guodong Liu
For electrochemical hydrogen evolution reaction (HER), developing high-performance catalysts without containing precious metals has been a major research focus in the current. Herein, we show the feasibility of HER catalytic enhancement in Ni-based materials based on topological engineering from hybrid Weyl states. Via a high-throughput computational screening from ∼140 000 materials, we identify a chiral compound NiSi is a hybrid Weyl semimetal (WSM) with showing bulk type-I and type-II Weyl nodes and long surface Fermi arcs near the Fermi level. Sufficient evidences verify that topological charge carriers participate in the HER process, and make the certain surface of NiSi highly active with the Gibbs free energy nearly zero (0.07 eV), which is even lower than Pt and locates on the top of the volcano plots. This work opens up a new routine to develop no-precious-metal-containing HER catalysts via topological engineering, rather than traditional defect engineering, doping engineering, or strain engineering.
对于电化学析氢反应(HER),开发不含贵金属的高性能催化剂一直是当前的研究热点。在此,我们证明了基于杂化Weyl态的拓扑工程在ni基材料中进行HER催化增强的可行性。通过对约140000种材料的高通量计算筛选,我们确定了手性化合物NiSi是一种杂化Weyl半金属(WSM),具有大量的i型和ii型Weyl节点和靠近费米水平的长表面费米弧。充分的证据证实拓扑载流子参与了HER过程,使得NiSi的某些表面具有高活性,其吉布斯自由能接近于零(0.07 eV),甚至低于Pt,位于火山地块的顶部。本研究为通过拓扑工程而不是传统的缺陷工程、掺杂工程或应变工程来开发无贵金属she催化剂开辟了一条新的途径。
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引用次数: 0
Highly Reflective Polymeric Coating for Passive Radiative Cooling Under Tropical Climate 用于热带气候下被动辐射冷却的高反射聚合物涂层
Pub Date : 2021-01-01 DOI: 10.2139/ssrn.3850366
Di Han, Jipeng Fei, Jyotirmoy Mandal, Zhixin Liu, M. Wan, Hong Li, A. Raman, B. Ng
Radiative cooling is a passive technology that lowers surface temperatures, which has shown great potential in temperate regions. However, cooling performance characterised by high solar irradiance and humidity under tropical climate still lacks exploration. Herein, we propose a highly reflective polymeric coating with BaSO4 particles dispersed in P(VdF-HFP) matrix for radiative cooling. Through the strong Mie scattering of sunlight and intrinsic bond vibration, the average substrate-independent solar reflectance and infrared emittance within the 8 to 13 μm atmospheric window could reach 97% and 94.2%, respectively. Under direct exposure to the sky, surfaces could maintain close to ambient temperatures even when the solar intensity was as high as 1000 W/m 2 , while separately achieving 5.7 °C below ambient during night-time with an effective cooling power of 54.4 W/m2. With a scalable fabrication-process, our cost-effective single-layer coating can be easily applied to diverse substrates, which is suitable for real-world applications in the tropics.
辐射冷却是一种降低地表温度的被动技术,在温带地区显示出巨大的潜力。然而,在热带气候条件下,以高太阳辐照度和高湿度为特征的制冷性能仍缺乏探索。在此,我们提出了一种高反射聚合物涂层,将BaSO4颗粒分散在P(VdF-HFP)基体中用于辐射冷却。通过强烈的米氏散射和本征键振动,在8 ~ 13 μm大气窗口内,平均与基片无关的太阳反射率和红外发射率分别达到97%和94.2%。在直接暴露于天空的情况下,即使太阳强度高达1000 W/m2,表面也能保持接近环境温度,而在夜间单独达到比环境温度低5.7°C,有效冷却功率为54.4 W/m2。凭借可扩展的制造工艺,我们具有成本效益的单层涂层可以很容易地应用于各种基材,这适用于热带地区的实际应用。
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引用次数: 0
The Mechanism of the High Resistance to Hydrogen-Induced Strength Loss in Ultra-High Strength High Entropy Alloy 超高强度高熵合金抗氢致强度损失的机理研究
Pub Date : 2021-01-01 DOI: 10.2139/ssrn.3910593
Zhenhuan Gao, Yunfei Xue, Jinxu Li, Lining Xu, Lijie Qiao
The resistance of Al0.5Cr0.9FeNi2.5V0.2 high entropy alloy (HEA) to hydrogen embrittlement was investigated by slow strain rate test (SSRT) and fracture surface was examined through scanning electron microscope. Compared with other ultra-high strength steels, Al0.5Cr0.9FeNi2.5V0.2 showed insignificant strength loss after hydrogen charging. The fracture surface of hydrogen charged specimens mainly consisted of dimples and no intergranular morphology was observed. The coupling effect of the dispersed nano-structured precipitates and high-density dislocations in Al0.5Cr0.9FeNi2.5V0.2 improves the resistance to hydrogen-induced strength loss.
采用慢应变率试验(SSRT)研究Al0.5Cr0.9FeNi2.5V0.2高熵合金(HEA)的抗氢脆性能,并通过扫描电镜观察断口形貌。与其他超高强度钢相比,Al0.5Cr0.9FeNi2.5V0.2充氢后强度损失不明显。充氢试样断口以韧窝为主,未观察到晶间形貌。Al0.5Cr0.9FeNi2.5V0.2中分散的纳米结构相与高密度位错的耦合作用提高了材料抗氢致强度损失的能力。
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引用次数: 0
Excellent Osteoinductivity of Biphasic Calcium Phosphate Bioceramics with the Optimal Design of Pore Size Distribution and Micro-Nano Topography 孔径分布和微纳形貌优化设计的双相磷酸钙生物陶瓷具有优异的骨诱导性
Pub Date : 2021-01-01 DOI: 10.2139/ssrn.3849027
Xiangfeng Li, F. Zhao, Fuying Chen, Xuening Chen, Yan Wang, Y. Xiao, Xing‐dong Zhang
Further enhance the bioactivity and osteoinductivity of biphasic calcium phosphate (BCP) bioceramics to meet the requirements of regenerative medicine is still a hot topic. Due to the uncontrolled pore structure and large grain size, the osteoinductivity of the conventional BCP bioceramics is restricted to a large extent. Herein, this study introduced a novel pore foaming method to fabricate BCP bioceramics with appropriately ordered macropores and abundant micropores by combing the advantages of the microsphere-sintering method with the H2O2 gas foaming method. Moreover, different sintering methods were adopted to adjust the micro-nano topography of BCP bioceramics. Due to the optimal design of pore size distribution and nano topography, the obtained BCP bioceramics could well trigger and regulate in vitro biological responses, such as degradation, bone-like apatite formation, protein adsorption, cell behaviors, angiogenic and osteogenic differentiation. In vivo canine intramuscular implantation further confirmed that the nanotopography and appropriately ordered pore structure might be responsible for the excellent neovascularization and osteoinductivity of the obtained BCP bioceramics. Collectedly, the osteoinductivity of BCP bioceramics was further enhanced by optimally designing pore structure and micro-nano topography, which hold huge potential to be a potential alternative to the gold standard of autogenous bone in bone repairing applications.
进一步增强双相磷酸钙(BCP)生物陶瓷的生物活性和骨诱导能力以满足再生医学的要求仍然是一个热门课题。常规BCP生物陶瓷由于孔隙结构不受控制和晶粒尺寸较大,在很大程度上限制了其成骨性。本研究结合微球烧结法和H2O2气相发泡法的优点,提出了一种新型孔隙发泡法,制备大孔有序、微孔丰富的BCP生物陶瓷。此外,采用不同的烧结方法来调整BCP生物陶瓷的微纳形貌。通过优化孔径分布和纳米形貌,制备的BCP生物陶瓷能够触发和调控体外生物反应,如降解、骨样磷灰石形成、蛋白质吸附、细胞行为、血管生成和成骨分化等。犬体内肌内植入进一步证实了纳米形貌和合理有序的孔隙结构可能是获得的BCP生物陶瓷具有良好的新生血管和成骨性的原因。综上所述,BCP生物陶瓷通过优化孔隙结构和微纳米形貌,进一步增强了其骨诱导能力,具有替代自体骨金标准在骨修复应用中的巨大潜力。
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引用次数: 0
Designing of Screen-Printed Stannous Oxide Thick Film Sensors Modified by Cobalt and Nitrogen for Sensing Some Toxic Gases and Volatile Organic Compounds 钴氮改性丝网印刷氧化亚锡厚膜传感器的设计及其对有毒气体和挥发性有机化合物的传感
Pub Date : 2021-01-01 DOI: 10.2139/ssrn.3894844
S. Ahire, A. V. Patil, A. Bachhav, P. B. Koli, T. B. Pawar
The present deals with fabrication of undoped SnO2, transition metal Co2+ doped SnO2 and non-metal nitrogen doped SnO2 nanostructures. These three materials were prepared by cost effective co-precipitation method. While the thick film sensor was design by screen printing photolithography technique. The fabricated materials were characterized by several techniques. The structural properties of the screen-printed thick films measured by X-ray diffractometer (XRD), which confirms the formation of tetragonal SnO2 nanoparticles with average particle size between 15 -17 nm. The morphological properties of fabricated thick of SnO2 were studied by scanning electron microscopy (SEM), and HR-TEM to get surface and lattice characteristics of prepared material. The EDS technique was utilized to get the elemental composition of the prepared thick film sensors. While the UV-DRS technique was used to get the band gap energy of undoped SnO2 and modified SnO2 sensors. Since, the sensors effectively work over the surface, hence the prepared sensors were investigated by BET) study, from BET results the cobalt modified SnO2 found to be higher surface area. These all-prepared sensors were applied for gas sensing results of NO2, LPG, CO and volatile organic compounds (VOC’S). The modified sensors found to be very effective at NO2 and VOC gas vapours with 80.23 % and 69.13% gas response for cobalt modified SnO2 was observed. The tested gases NO2 and VOC found to be very selective modified sensors. Reusability and recycling results demonstrate that Co2+ doped SnO2 is very efficient, long time stable and reproducible sensor at NO2 and VOC gases.
本文研究了未掺杂SnO2、过渡金属Co2+掺杂SnO2和非金属氮掺杂SnO2纳米结构的制备。采用经济有效的共沉淀法制备了这三种材料。厚膜传感器采用丝网印刷光刻技术设计。所制备的材料通过多种技术进行了表征。用x射线衍射仪(XRD)测量了丝网印刷厚膜的结构性能,证实形成了平均粒径在15 ~ 17 nm之间的四边形SnO2纳米颗粒。采用扫描电镜(SEM)和透射电镜(HR-TEM)研究了制备的SnO2厚度的形貌特征,得到了制备材料的表面和晶格特征。利用能谱分析技术测定了所制备的厚膜传感器的元素组成。而UV-DRS技术则用于获得未掺杂SnO2和改性SnO2传感器的带隙能量。由于传感器有效地在表面工作,因此对所制备的传感器进行了BET研究,从BET结果中发现钴修饰的SnO2具有更高的表面积。将这些传感器应用于NO2、LPG、CO和挥发性有机物(VOC)的气敏检测结果。改性后的传感器在NO2和VOC气体蒸汽中非常有效,对钴改性SnO2的气体响应率分别为80.23%和69.13%。被测试的气体NO2和VOC被发现是非常选择性修改的传感器。结果表明,在NO2和VOC气体下,Co2+掺杂SnO2是一种高效、长时间稳定、可重复使用的传感器。
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引用次数: 1
Preparation and Mineralogical, Spectroscopic and Granulometric Characterization of a Natural Adsorbent Based on a Mixture of Shells from Mehdia Beaches (Morocco) 一种基于摩洛哥迈迪亚海滩贝壳混合物的天然吸附剂的制备及其矿物学、光谱和粒度表征
Pub Date : 2021-01-01 DOI: 10.2139/ssrn.3901853
M. Allaoui, M. Berradi, Achraf Khaddari, H. Erramli, Said Ibn Ahmed
During this study, we realized the preparation of an adsorbent based on shellfish taken from different areas of the beach of Mehdia (Morocco), and then we carried out their characterization by quantitative (XRD), qualitative (FTIR), optical (SEM-EDS) and granulometric analyses. The results obtained during this study show the shellfish studied is composed of the main minerals such as aragonite (68%) and calcite (32%) while an absence of vaterite. In addition, it shows that the crystalline structure of these shells is mainly composed of two polymorphs of calcium carbonate, namely calcite (CaCO3 (90.7%)) and aragonite (CaCO3 (43.9%)) of better stability. Moreover, they have shown that these calcium carbonates have an extensive porous structure with a specific surface consisting of a heterogeneous layer characterized by rounded particles and other mineral traces. This allows these carriers be used to as adsorbents applied in the removal of heavy metals from wastewater before discharge into the receiving environment.
在本研究中,我们以摩洛哥Mehdia海滩不同区域的贝类为原料制备了一种吸附剂,并对其进行了定量(XRD)、定性(FTIR)、光学(SEM-EDS)和粒度分析等表征。研究结果表明,贝类的主要矿物为文石(68%)和方解石(32%),不含水晶石。此外,这些壳的晶体结构主要由碳酸钙的两种多晶型组成,即稳定性较好的方解石(CaCO3(90.7%))和文石(CaCO3(43.9%))。此外,他们还表明,这些碳酸钙具有广泛的多孔结构,其特定表面由以圆形颗粒和其他矿物痕迹为特征的非均质层组成。这使得这些载体被用作吸附剂,用于在排放到接收环境之前从废水中去除重金属。
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引用次数: 0
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Chemical Engineering (Engineering) eJournal
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