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MATERIALS RESEARCH BULLETIN · 2017 · IF 2.446

First-principle calculations and experimental investigation on the infrared emissivity property of Mg-doped ZnO

Tengchao Guo,Guoyue Xu,Shujuan Tan,Ning Liu,Jianchao Zhang,Xiangxiong Zeng,Juan Liang

The electronic properties and infrared emissivity of Zn 1-x Mg x O (x   =   0, 0.0625, 0.125) were systematically investigated by using the first-principle calculation s based on density functional theory (DFT). The Zn 1-x Mg x O (x   =   0, 0.0625, 0.125) powders were prepared by sol-gel method and their infrared emissivity in the wavelength of 8–14   μm was characterized. The results indicate that the infrared emissivity increases with the increase in Mg concentration, which is attributed to the reduction in conductivity and in the real part of dielectric function. Furthermore, the variation in conductivity and dielectric function has been well studied, and a reasonable method to calculate infrared emissivity of semiconductors has been established. It is expected that this method can be used for designing materials with different infrared emissivity and also applied for effectively guiding the experimental investigation.

研究领域: 材料科学 · 凝聚态物理 · 计算材料学 · 功能材料 · 半导体物理
✓ 已验证 DOI 高影响因子
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JOURNAL OF ALLOYS AND COMPOUNDS · 2024 · IF 5.8

Efficient electrochemical synthesis of Cu3Si/Si hybrids as negative electrode material for lithium-ion battery

Siwei Jiang,Jiaxu Cheng,G.P. Nayaka,Peng Dong,Yingjie Zhang,Yubo Xing,Xiaolei Zhang,Ning Du,Zhongren Zhou

Nanoscaling and alloying techniques for silicon-based materials are widely recognized as vital technological approaches to effectively address the challenges associated with volume expansion and poor conductivity in silicon anodes. Developing short process, cost-effective preparation methods and shape controllable silicon-based materials is expected to improve their cyclability. Herein, utilizing the superior electrical conductivity of copper metal and its stable alloy interaction with silicon, the present study introduced a simple synthetic process by incorporating nanoscale Cu 2 O into a SiO 2 dioxide matrix under a combination of hydrothermal reaction with Cu(NO 3 ) 2 as the copper source and further sintering treatment. Under the conditions of a Cu:Si molar ratio to 3:8 under 850 °C by 2.6 V of constant electrolsyis for 3 h, straight silicon nanowires with a cross-sectional distribution were obtained. The Cu 3 Si alloy particles were enriched around silicon nanowires. Experimental testing was conducted to evaluate the electrochemical storage capabilities of Cu 3 Si/Si nanowires, resulting in an initial specific capacity of 2630.7 mAh g -1 and an initial coulombic efficiency of 88.94%. After 100 charge-discharge cycles, the discharge specific capacity reached 1675.4 mAh g -1 , with a capacity retention rate of 66.20%. This work demonstrates the effectiveness of constructing a Cu 3 Si conductive network for solving the volume expansion and conductivity problems of Si and the distinctive Cu 3 Si/Si architecture offers an exemplary model for the design of silicon-based composite anodes for advanced lithium-ion batteries.

研究领域: 材料科学 · 电化学 · 纳米科技 · 能源存储 · 复合材料 · 半导体材料
✓ 已验证 DOI 高影响因子
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DALTON TRANSACTIONS · 2022 ·Vol. 51 ·期 45 ·17328-17337 · IF 4.569

Solvent engineering to regulate the phase of copper zinc tin sulfide nanocrystals

Yan Zhu,Hongmei Qing,Wenbo Dong,Mingrong Dong,Tao Shen,Jian Cui

Copper zinc tin sulfide (Cu2ZnSnS4, CZTS) is attracting interest in photovoltaic applications due to its proper band gap, low cost and low toxicity. It has been found that two phases can be fabricated, i.e. kesterite and wurtzite CZTS structures. Though kesterite CZTS is proven to be thermodynamically stable, the free energy difference between kesterite and wurtzite CZTS is rather small. So, wurtzite CZTS can also stably exist under ambient conditions. Controlling the phase formation can expand the dimensions to optimize the performance of applications based on CZTS. In this study, we found that phase control can be achieved by simply using a mixed solvent of ethylene glycol and triethylenetetramine (TETA) in a two-stage heating process. It is found that the incorporation of the reductive solvent of TETA during the 1st heating process converts the phase of the precipitates from CuS (TETA poor) to Cu7S4 (TETA rich). In the subsequent 2nd heating stage, the phase of the final products is determined to be kesterite CZTS originating from CuS and wurtzite CZTS from Cu7S4, respectively. Thus, the key to control the phases of the final products is to control the chemical environment of Cu under Cu1+-rich or Cu2+-rich conditions in the fabrication process, which corresponds to the phase of the final products of wurtzite CZTS or kesterite CZTS, respectively. This summarized principle can not only be used to explain the previous versatile experimental results but also to guide the controlled synthesis of various phases of CZTS and CZTS-like materials in applications.

研究领域: 材料科学 · 无机化学 · 半导体材料 · 纳米科技 · 光伏材料
✓ 已验证 DOI 高影响因子
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MATERIALS RESEARCH BULLETIN · 2012 ·Vol. 47 ·期 11 ·3277-3282 · IF 2.105

High-yield synthesis of SnO2 nanobelts by water-assisted chemical vapor deposition for sensor applications

Jing Bo Zhang,Xiao Ning Li,Shou Li Bai,Rui Xian Luo,Ai Fan Chen,Yuan Lin

Well-crystallized one-dimensional (1D) SnO 2 nanobelts were in situ prepared using a simple water-assisted chemical vapor deposition (CVD) method. The small Sn particles with Au-modifications were used as source materials instead of big size Sn grains to ensure the high yield of SnO 2 belts. The Au layer was modified on the small Sn particles by treating Sn powders in HAuCl 4 solution combined with the UV irradiation. The as-prepared SnO 2 nanobelts were characterized by SEM, HRTEM, XRD, EDS and XPS. These results indicate that the growth temperature plays an important role in controlling the length-to-width ratio of nanobelts. The length-to-width ratio decreases with the growth temperature from 850   °C to 1000   °C. The nanobelts prepared at 850   °C shows a single-crystalline tetragonal rutile phase with a high length-to-width ratio (approximately tens of microns in length and 40–70   nm in width). However, below 850   °C, nanobelts cannot be formed. The as-prepared nanobelts exhibited excellent sensing properties compared with SnO 2 nanoparticles and high sensing selectivity towards NO 2 . The high sensing selectivity to NO 2 is attributed to the oxygen vacancies presenting in the as-prepared nanobelts.

研究领域: 材料科学 · 纳米技术 · 传感器学 · 无机化学 · 半导体材料
✓ 已验证 DOI 高影响因子
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RSC Advances · 2016 ·Vol. 6 ·期 100 ·97783-97790 · IF 3.289

Functionalization of side chain terminals with fused aromatic rings in carbazole–diketopyrrolopyrrole based conjugated polymers for improved charge transport properties

Ying Sun,Qizan Huang,Xueqin Zhang,Xiaojing Ding,Pei Han,Baoping Lin,Hong Yang,Lingxiang Guo

In recent years, side chain engineering has been proven to play a critical role in the development of high performance conjugated polymers for organic electronics. Here, we report a new strategy to improve charge transport property through side chain functionalization. A series of carbazole–diketopyrrolopyrrole based conjugated polymers P1, P2 and P3 with different side chains have been designed and synthesized. For P2 and P3, a pyrene and carbazole unit were incorporated into the terminal of the alkyl side chain, respectively. Thermal properties, crystallinities, UV-vis absorptions, electrochemical properties as well as charge transport properties of the polymers were investigated in detail. Interestingly, results showed that incorporation of the fused aromatic ring into the side chain terminal not only changed the absorption and electrochemical properties, but also affected the charge transport properties. The pyrene and carbazole group in the side chain terminal significantly promoted aggregation of the polymer chains, which would provide short-range order for improved charge carrier mobility. Compared to the hole mobility (0.019 cm2 V−1 s−1) for polymer P1 with the whole alkyl chains, increased hole mobilities of 0.081 cm2 V−1 s−1 and 0.052 cm2 V−1 s−1 were achieved for polymer P2 and polymer P3, respectively. It is worthy to note that our strategy gives rise to no increment of the crystallinity of the polymer, being beneficial for the practical application of soft electronics since high crystallinity of the material usually leads to poor thin film uniformity and weak mechanical resilience. In this respect, we offer a promising tool to aid rational polymer design for enhanced charge transport property.

研究领域: 高分子化学 · 有机电子学 · 材料科学 · 半导体材料 · 光电功能材料
✓ 已验证 DOI 高影响因子
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PHYSICAL CHEMISTRY CHEMICAL PHYSICS · 2018 ·Vol. 20 ·期 44 ·28068-28074 · IF 3.906

Photo-induced dual passivation via Usanovich acid–base on surface defects of methylammonium lead triiodide perovskite

Yue Yu,Sushu Wan,Daocheng Hong,Yuxi Tian

Post-fabrication defect passivation of organometal halide perovskites has become an efficient way to improve their photophysical properties, but the underlying mechanisms are still in debate. In this work, we used p-benzoquinone (p-BQ) to generate surface defects on methylammonium lead triiodide perovskite (MAPbI3), and found that a Usanovich acid–base (O2, acetone or acetonitrile) treatment can effectively passivate those defects and lead to photoluminescence (PL) enhancement. The passivation effect arose from partial neutralization of defect charges via electron transfer between passivation reagents and relevant defects. O2 accepted photo-generated electrons, formed negatively charged oxygen species and attached to the I vacancy site to reduce its PL quenching efficiency by neutralising the defects positive charge. Likewise, acetone accepted photo-generated holes, formed positively charged species and partially neutralised the defects negative charge. The reduced trapping ability of defects caused PL enhancement. In addition, the observed photo-catalysed oxidation of acetone by O2 on the crystal surface supported the single electron transfer mechanism, and showed the potential of MAPbI3 as a photo-catalyst.

研究领域: 材料科学 · 光物理学 · 半导体材料 · 表面化学 · 光电功能材料
✓ 已验证 DOI 高影响因子
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MATERIALS LETTERS · 2014 · IF 2.269

Colloidal synthesis of chalcostibite copper antimony sulfide nanocrystals

Yu Zou,Jiang Jiang

We report the colloidal synthesis of monodisperse phase pure chalcostibite CuSbS 2 nanocrystals in high boiling point solvent. The use of dodecanethiol as ligands had an advantage over oleylamine on avoiding the hydrolysis of Sb precursor. The effect of reaction temperature and Cu/Sb feed molar ratio on the synthesis of copper antimony sulfide nanocrystals in dodecanethiol system was investigated. As a result of the reactivity difference between Cu and Sb precursors, the formation of CuSbS 2 nanocrystals involves the preferential nucleation of Cu-rich nanocrystals and their subsequent reaction with remaining Sb precursors. The band gap of the resulting CuSbS 2 nanocrystals was measured to be ~1.59   eV.

研究领域: 材料化学 · 纳米科学 · 无机化学 · 半导体材料 · 胶体化学
✓ 已验证 DOI 高影响因子
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JOURNAL OF LUMINESCENCE · 2019 · IF 2.961

Synthesis and photoluminescence properties of CsPbBr3 quantum dots by using para-xylene as the anti-solvent

Hui Gao,Siyuan Liu,Zhipeng Xue,Wenjing Liu,Yanguang Nie,Guoqing Chen,Xiaolong Li

Herein, CsPbBr 3 quantum dots (QDs) were successfully synthesized via the supersaturated recrystallization (SR) method by using para-xylene as the anti-solvent. The as-prepared CsPbBr 3 QDs exhibited high quantum efficiency (78%) and narrow luminescent peaks with a full width at half maximum of around 21.2 nm. Compared with the commonly-used anti-solvents, para-xylene shows low toxic effect and high freezing point (13.3 °C). Therefore, CsPbBr 3 QDs can be easily preserved in the refrigerator like an ice-cream for further use. The maximum photoluminescence (PL) emission intensity would reach 90% retention after 60 days’ storage in the refrigerator. By using this simple method, the stability of CsPbBr 3 QDs has been effectively improved for long-term storage and further application.

研究领域: 材料科学 · 纳米科技 · 光电子学 · 无机化学 · 半导体材料
✓ 已验证 DOI 高影响因子
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JOURNAL OF SOLID STATE CHEMISTRY · 2016 · IF 2.265

Facile synthesis of CuSe nanoparticles and high-quality single-crystal two-dimensional hexagonal nanoplatelets with tunable near-infrared optical absorption

Yimin Wu,Ilia Korolkov,Xvsheng Qiao,Xianghua Zhang,Jun Wan,Xianping Fan

A rapid injection approach is used to synthesize the copper selenide nanoparticles and two-dimensional single crystal nanoplates . This technique excludes the use of toxic or expensive materials, increasing the availability of two-dimensional binary chalcogenide semiconductors. The structure of the nanocrystals has been studied and the possible formation mechanism of the nanoplates has been proposed. The optical absorption showed that the nanoplates demonstrated wide and tuneable absorption band in the visible and near infrared region . These nanoplates could be interesting for converting solar energy and for nanophotonic devices operating in the near infrared .

研究领域: 材料科学 · 纳米科技 · 半导体材料 · 光电子学 · 能源材料
✓ 已验证 DOI 高影响因子
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MATERIALS LETTERS · 2015 · IF 2.489

Solvothermal synthesis and visible light absorption of anatase TiO2

Jingzhong Zhao,Weiqiang Xing,Yang Li,Kathy Lu

Oxygen-deficient anatase TiO 2 sheets with dominant (001) facets are becoming a hot research topic due to their promising high activity in heterogeneous reactions . In this work, a series of (001) facets dominated TiO 2 with distributed oxygen vacancies and Ti 3+ was prepared by a simple hydrothermal method with the TiB 2 as a precursor. The as-prepared powders were characterized by X-ray diffraction (XRD), Scanning electron microscope (SEM), Transmission Electron Microscope (TEM), X-ray photoelectron spectroscopy (XPS) and UV–visible diffuse reflectance spectroscopy (UV–vis). The results show that the particle size of as-prepared TiO 2 increases and its band gap narrows with the hydrothermal temperature increasing from 140   °C to 180   °C. Besides, oxygen vacancies and Ti 3+ are generated during the TiB 2 hydrolysis, which leads to new absorption spectrum in the visible light region. Photocatalytic test shows that sample prepared at 180   °C presents the highest degradation efficiency.

研究领域: 材料科学 · 光催化 · 纳米材料 · 表面化学 · 半导体材料
✓ 已验证 DOI 高影响因子
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PARTICLE & PARTICLE SYSTEMS CHARACTERIZATION · 2023 ·Vol. 40 ·期 8 ·2300032 · IF 2.7

One-Step Preparation of Ion-Doped Cesium Lead Halide Perovskite Nanocrystals by Ultrasonication

Hao Jiang,Chenxi Zang,Yixiu Dong,Min Lai,Shuhong Xu,Jingkun Xu

CsPbX 3 (X = Cl, Br, I) nanocrystals (NCs) are competitive materials for a wide range of applications because of their outstanding optoelectronic properties. Ion doping has been demonstrated as one powerful method for improving the optical properties of CsPbX 3 NCs. However, the conventional ion-doping approaches are tedious, and generally performed under an inert atmosphere and high temperature. In this work, a one-step ultrasonic-assisted approach is demonstrated to prepare doped CsPbX 3 NCs. To demonstrate the universality of the ultrasonic-assisted ion-doping approach, three ion-doped perovskite NCs are prepared, which represent three common improvements effects of ion doping on perovskite NCs, namely improved stability, PL emission, and photoluminescence quantum yields (PLQYs) of perovskite NCs. Sr-doped CsPbI 3 NCs showed improved phase stability. Mn-doped CsPbCl 3 NCs showed dual-color emissions at 406 and 580 nm. The PLQYs of the as-prepared Ni-doped CsPbCl 3 NCs are greatly improved, from 10.1% to 71%. Such a simple and versatile ion-doping approach may promote the practical applications of all-inorganic perovskite NCs.

研究领域: 材料科学 · 纳米技术 · 光电子学 · 无机化学 · 半导体材料
✓ 已验证 DOI 高影响因子
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MATERIALS CHEMISTRY AND PHYSICS · 2019 · IF 2.781

Achieving superior electrochemical performances on LiNi0.8Co0.15Al0.05O2 cathode materials by cadmium oxide modification

Yunjiao Li,Shilei Wang,Yongxiang Chen,Tongxing Lei,Shiyi Deng,Jie Zhu,Jinping Zhang,Jia Guo

Cadmium oxides (CdO), an important semiconductor material , have many superior properties when used as a cathode material for nickel-cadmium batteries. Here, the coating and the doped co-modified LiNi 0.8 Co 0.15 Al 0.05 O 2 cathode are constructed by a continuous wet chemical process and a high-temperature sintering process, wherein the Cd 2+ are uniformly doped in a gradient form and the CdO protective layer is distributed on the outer surface of secondary particles. The Cd-modified NCA material has more stable interfacial and crystal lattice structure, thereby inhibiting harmful phase transitions and side-reactions. Accordingly, the modified sample has excellent electrochemical performance and maintaining a complete spherical morphology during long cycling compared to the pristine sample. In addition, as a pillar ion, cadmium increases the plate spacing and lithium-ion diffusion kinetics. The electrochemical results show that the capacity retention of the modified sample Cd-2000 reached 96.5% and 90.6% after 100 cycles and 200 cycles respectively at 1 C. At the high current rate of 8 C, the initial capacity and retention (100 cycles, 3.0–4.3 V) reach 166.2 mAh g −1 and 95.2%, respectively. Besides, the results of electrochemical impedance spectroscopy (EIS) reveal that CdO modification could decrease the resistance of the cell polarization and impedance increment upon cycling.

研究领域: 材料科学 · 电化学 · 能源存储 · 无机化学 · 半导体材料
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