Journal of Solid State Chemistry最新文献

筛选
英文 中文
α-Bi2O3 tubular rods coated on Bi2O2CO3 nanosheets for high-performance asymmetric supercapacitor applications 涂覆在 Bi2O2CO3 纳米片上的 α-Bi2O3 管状棒用于高性能不对称超级电容器应用
IF 3.2 3区 化学
Journal of Solid State Chemistry Pub Date : 2024-09-10 DOI: 10.1016/j.jssc.2024.125008
Sethumathavan Vadivel , P. Sujita , Bappi Paul , Harshavardhan Mohan
{"title":"α-Bi2O3 tubular rods coated on Bi2O2CO3 nanosheets for high-performance asymmetric supercapacitor applications","authors":"Sethumathavan Vadivel ,&nbsp;P. Sujita ,&nbsp;Bappi Paul ,&nbsp;Harshavardhan Mohan","doi":"10.1016/j.jssc.2024.125008","DOIUrl":"10.1016/j.jssc.2024.125008","url":null,"abstract":"<div><p>Mixed phases of bismuth oxide nanostructures as an active electrode material in supercapacitor applications have recently gained huge research interest. In this study, the layered Bi<sub>2</sub>O<sub>2</sub>CO<sub>3</sub> nanosheets and the secondary phase of α-Bi<sub>2</sub>O<sub>3</sub> tubular rods named Bi<sub>2</sub>O<sub>2</sub>CO<sub>3</sub>/α-Bi<sub>2</sub>O<sub>3</sub> heterostructure have been synthesized and utilized for supercapacitor applications. The crystal nature and microstructure of the Bi<sub>2</sub>O<sub>2</sub>CO<sub>3</sub>/α-Bi<sub>2</sub>O<sub>3</sub> heterostructure were initially confirmed by powder X-ray diffraction (<em>p</em>-XRD), Raman, UV-Vis diffuse reflectance spectroscopy (UV-DRS, absorbance), scanning electron microscopy (SEM), and transmission electron microscopy (TEM) studies. X-ray photoelectron spectroscopy (XPS) measurements have investigated the oxidation states and chemical binding energies. Regarding the electrochemical performances, the Bi<sub>2</sub>O<sub>2</sub>CO<sub>3</sub>/α-Bi<sub>2</sub>O<sub>3</sub> heterostructure as electro-active material delivered a maximum specific capacitance (C<sub>s</sub>) value of 635 F g<sup>−1</sup> at the given current density value of 1 A g<sup>−1</sup> in a conventional three-electrode mode. A coin cell type electrode has been fabricated using Bi<sub>2</sub>O<sub>2</sub>CO<sub>3</sub>/α-Bi<sub>2</sub>O<sub>3</sub> heterostructure, resulting in an asymmetric supercapacitor device cell (ASC), which has a C<sub>s</sub> of 112 F g<sup>− 1</sup> (at 1 A g<sup>− 1</sup>) and a power density and energy density values of 515 W kg<sup>−1</sup> and 22.5 Wh kg<sup>−1</sup> respectively. The two supercapacitor electrodes in sequence effectively ignite the red-light-emitting diode (LED). Moreover, in the ASC type Bi<sub>2</sub>O<sub>2</sub>CO<sub>3</sub> /α-Bi<sub>2</sub>O<sub>3</sub> heterostructure, the specific capacitance value was slightly reduced to 12.3 % by 2000 cycles, showing favourable cyclic performance and stability during the electrochemical process. Based on the above-mentioned characterization, the appropriate electrochemical performances of Bi<sub>2</sub>O<sub>2</sub>CO<sub>3</sub>/α-Bi<sub>2</sub>O<sub>3</sub> tubular rod heterostructures make them a promising candidate for future energy storage devices.</p></div>","PeriodicalId":378,"journal":{"name":"Journal of Solid State Chemistry","volume":"340 ","pages":"Article 125008"},"PeriodicalIF":3.2,"publicationDate":"2024-09-10","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142232834","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Design and preparation of carbon-coated NaZnFe(MoO4)3 composite as novel anode materials for lithium/sodium-ion batteries 设计和制备碳涂层 NaZnFe(MoO4)3复合材料作为锂/钠离子电池的新型负极材料
IF 3.2 3区 化学
Journal of Solid State Chemistry Pub Date : 2024-09-10 DOI: 10.1016/j.jssc.2024.125007
Xin Zhao, Xiuxia Lu, Limin Zhang, Jianyin Zhang
{"title":"Design and preparation of carbon-coated NaZnFe(MoO4)3 composite as novel anode materials for lithium/sodium-ion batteries","authors":"Xin Zhao,&nbsp;Xiuxia Lu,&nbsp;Limin Zhang,&nbsp;Jianyin Zhang","doi":"10.1016/j.jssc.2024.125007","DOIUrl":"10.1016/j.jssc.2024.125007","url":null,"abstract":"<div><p>The investigation of new anode materials with novel crystal structure and high ionic conductivity is of great significance for potential applications in lithium/sodium-ion batteries. Herein, carbon-coated NaZnFe(MoO<sub>4</sub>)<sub>3</sub> composite was produced by solid state method coupled with the mechanical ball milling technique. The crystal and morphology were accurately confirmed by XRD, XPS and SEM techniques. When tested with lithium-ion batteries, the charging capacity reached an impressive 1005 mA h g<sup>−1</sup> during the initial cycle and 840 mA h g<sup>−1</sup> after 50 cycles, resulting in a capacity retention of 84.2 %. This performance is 40 % higher than that of the sample without a carbon layer coating. When utilized as an anode for sodium-ion batteries, the carbon-coated NaZnFe(MoO<sub>4</sub>)<sub>3</sub> composite electrode exhibited a remarkable specific capacity of 152 mA h g<sup>−1</sup> and a high capacity retention of 74.9 % after 100 cycles at a rate of 100 mA g<sup>−1</sup>. Furthermore, the charge capacity was measured at 105 mA h g<sup>−1</sup> after 500 cycles test conducted at 500 mA g<sup>−1</sup>, with a capacity retention of 86.0 %. The advantages of polyanionic molybdate NaZnFe(MoO<sub>4</sub>)<sub>3</sub> combined with the simple carbon coating strategy make it possible to application in the next generation of Li/Na secondary batteries.</p></div>","PeriodicalId":378,"journal":{"name":"Journal of Solid State Chemistry","volume":"340 ","pages":"Article 125007"},"PeriodicalIF":3.2,"publicationDate":"2024-09-10","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142229295","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Efficient palladium ion adsorption and catalyst preparation from pharmaceutical wastewater using amino-functionalized Ti3C2 利用氨基功能化 Ti3C2 从制药废水中高效吸附钯离子并制备催化剂
IF 3.2 3区 化学
Journal of Solid State Chemistry Pub Date : 2024-09-10 DOI: 10.1016/j.jssc.2024.125006
Dancheng Zhu, Yonghui Lin, Changhui Chen, Hao Xu, Jiabin Shen, Jun Qiao, Chao Shen
{"title":"Efficient palladium ion adsorption and catalyst preparation from pharmaceutical wastewater using amino-functionalized Ti3C2","authors":"Dancheng Zhu,&nbsp;Yonghui Lin,&nbsp;Changhui Chen,&nbsp;Hao Xu,&nbsp;Jiabin Shen,&nbsp;Jun Qiao,&nbsp;Chao Shen","doi":"10.1016/j.jssc.2024.125006","DOIUrl":"10.1016/j.jssc.2024.125006","url":null,"abstract":"<div><p>This paper reports the recovery and reuse of Pd ions from pharmaceutical wastewater using amino-modified Ti<sub>3</sub>C<sub>2</sub>. Ti<sub>3</sub>C<sub>2</sub>–NH<sub>2</sub> was synthesized by modifying (3-aminopropyl)triethoxysilane and the successful substitution of some surface functional groups of Ti<sub>3</sub>C<sub>2</sub>; the decrease in material thickness was verified by characterization. This study revealed that the presence of amino groups significantly enhanced the Pd(II) adsorption capacity of Ti<sub>3</sub>C<sub>2</sub>. The effects of the adsorbent material, adsorbent dosage, pH, initial concentration of Pd ions, presence of competing cations, and contact time on the adsorption performance were investigated. The maximum adsorption capacity of 20 mg of Ti<sub>3</sub>C<sub>2</sub>–NH<sub>2</sub> was 986.65 mg/g in 100 ml of a Pd-ion solution with an initial concentration of 200 mg/l at pH 3. A pseudo-second-order kinetic model fitted well with the experimentally obtained rate data, indicating that the main mode of Pd-ion removal by Ti<sub>3</sub>C<sub>2</sub>–NH<sub>2</sub> was via chemical reduction. Finally, the catalyst exhibited excellent performances during the photocatalytic and Suzuki coupling reactions with yields of 81 % and 95 %, respectively. The results demonstrated that Ti<sub>3</sub>C<sub>2</sub>–NH<sub>2</sub> is an excellent material for adsorbing Pd ions and can effectively recycle these ions from pharmaceutical wastewater.</p></div>","PeriodicalId":378,"journal":{"name":"Journal of Solid State Chemistry","volume":"340 ","pages":"Article 125006"},"PeriodicalIF":3.2,"publicationDate":"2024-09-10","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142162716","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Crystal chemical investigations on TiU8S17 and U36Lu21S93I3 - ordered and disordered multinary uranium sulfides TiU8S17和U36Lu21S93I3--有序和无序的二元铀硫化物的晶体化学研究
IF 3.2 3区 化学
Journal of Solid State Chemistry Pub Date : 2024-09-05 DOI: 10.1016/j.jssc.2024.124998
Marvin Michak , Thomas Ruf , Reinhard Denecke , Christopher Benndorf , Aaron Haben , Ralf Kautenburger , Holger Kohlmann
{"title":"Crystal chemical investigations on TiU8S17 and U36Lu21S93I3 - ordered and disordered multinary uranium sulfides","authors":"Marvin Michak ,&nbsp;Thomas Ruf ,&nbsp;Reinhard Denecke ,&nbsp;Christopher Benndorf ,&nbsp;Aaron Haben ,&nbsp;Ralf Kautenburger ,&nbsp;Holger Kohlmann","doi":"10.1016/j.jssc.2024.124998","DOIUrl":"10.1016/j.jssc.2024.124998","url":null,"abstract":"<div><p>The crystal chemistry of uranium sulfides is characterized by a large diversity in composition, crystal structures, oxidation states and physical properties. This holds also for TiU<sub>8</sub>S<sub>17</sub> and U<sub>36</sub>Lu<sub>21</sub>S<sub>93</sub>I<sub>3</sub>, of which large single crystals up to several mm in length were grown by chemical vapor transport using iodine as a transport agent. TiU<sub>8</sub>S<sub>17</sub> crystallizes with the monoclinic CrU<sub>8</sub>S<sub>17</sub> structure type (<em>C</em>2/<em>m</em>, <em>a</em> = 13.3477(2) Å, <em>b</em> = 8.4927(2) Å, <em>c</em> = 10.4836(2) Å, <em>β</em> = 101.207(2)°) featuring distorted octahedra [TiS<sub>6</sub>] and bicapped trigonal prisms [US<sub>8</sub>]. Interatomic distances and X-ray photoelectron spectra indicate tetravalent uranium. Disordered U<sub>36</sub>Lu<sub>21</sub>S<sub>93</sub>I<sub>3</sub> represents a new structure type (<span><math><mrow><mtext>R</mtext><mover><mn>3</mn><mo>¯</mo></mover><mtext>0</mtext></mrow></math></span>, 13.3841(2) Å, 20.6447(2) Å) with an average crystal structure exhibiting square antiprisms [LuS<sub>8</sub>], bi- and tricapped trigonal prisms [US<sub>8</sub>] and [US<sub>9</sub>] and distorted octahedra [IU<sub>6</sub>]. Lutetium and sulfur atoms are disordered similar to Ce<sub>53</sub>Fe<sub>12</sub>S<sub>90</sub><em>X</em><sub>3</sub>, La<sub>53</sub>Fe<sub>12</sub>S<sub>90</sub><em>X</em><sub>3</sub> (<em>X</em> = Cl, Br, I) and La<sub>52</sub>Fe<sub>12</sub>S<sub>90</sub>. This might be caused by positional shifts of iodine atoms away from the center of the polyhedron, thus avoiding unusually long U–I distances and severely disrupting the order of neighboring lutetium and sulfur atoms. The results of chemical analyses (ICP-MS, EDX), electron microscopy (TEM) and X-ray photoelectron spectroscopy support the composition and crystal structure of U<sub>36</sub>Lu<sub>21</sub>S<sub>93</sub>I<sub>3</sub> and indicate mixed valency of uranium and charge balance according to the crystal chemical formula (U<sup>+</sup><sup>III</sup>)<sub>18</sub>(U<sup>+</sup><sup>IV</sup>)<sub>18</sub>(Lu<sup>+</sup><sup>III</sup>)<sub>21</sub>(S<sup>-II</sup>)<sub>93</sub>(I<sup>–</sup><sup>I</sup>)<sub>3</sub>.</p></div>","PeriodicalId":378,"journal":{"name":"Journal of Solid State Chemistry","volume":"340 ","pages":"Article 124998"},"PeriodicalIF":3.2,"publicationDate":"2024-09-05","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.sciencedirect.com/science/article/pii/S0022459624004523/pdfft?md5=ed76b350b5ff42e5679593a766b02be7&pid=1-s2.0-S0022459624004523-main.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142243344","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Effect of Mn substitution on crystal structure and cyclic property of Y–Ni alloy with superlattice structure 锰替代对超晶格结构 Y-Ni 合金晶体结构和循环特性的影响
IF 3.2 3区 化学
Journal of Solid State Chemistry Pub Date : 2024-09-05 DOI: 10.1016/j.jssc.2024.125001
Kenji Iwase , Reon Kunimoto , Ryuichi Katagiri , Kazuhiro Mori
{"title":"Effect of Mn substitution on crystal structure and cyclic property of Y–Ni alloy with superlattice structure","authors":"Kenji Iwase ,&nbsp;Reon Kunimoto ,&nbsp;Ryuichi Katagiri ,&nbsp;Kazuhiro Mori","doi":"10.1016/j.jssc.2024.125001","DOIUrl":"10.1016/j.jssc.2024.125001","url":null,"abstract":"<div><p>This study investigated the crystal structure, P–C isotherm, and cyclic properties of YNi<sub>3</sub>. We discovered that hydrogen-induced amorphization (HIA) was appeared in three cycles of P–C isotherm at 303 K, but it was not observed at 273 K. An analysis of the three cycles at 303 K revealed a 55 % decrease in hydrogen capacity as compared to the first cycle. To enhance the hydrogenation properties, Mn was substituted for Ni. X-ray Rietveld refinements on YNi<sub>2·7</sub>Mn<sub>0·3</sub>H<sub>3.8</sub> reveal that the hydride phase retains the PuNi<sub>3</sub>-type structure of the original alloy. The values of <em>a, c</em>, the unit cell, the MgZn<sub>2</sub>-type cell, and the CaCu<sub>5</sub>-type cell expanded 5.6 %, 9.3 %, 21.9 %, 25.0 %, and 18.8 % from the original alloy. The results indicated that YNi<sub>2·7</sub>Mn<sub>0.3</sub> retained 91 % of its initial hydrogen capacity after three cycles at 303 K. After 120 cycles in the cyclic test, YNi<sub>3</sub> and YNi<sub>2·7</sub>Mn<sub>0.3</sub> retained 42 % and 90 % of their initial capacity, respectively. The XRD profile of YNi<sub>3</sub> after 120 absorption-desorption cycles revealed significant peak broadening. Similarly, peak broadening was also observed in the XRD profile of YNi<sub>2·8</sub>Mn<sub>0.2</sub> after 120 cycles. In comparison, the XRD profile of YNi<sub>2·7</sub>Mn<sub>0.3</sub> after 120 cycles remained relatively unchanged from its initial state. It was observed that YNi<sub>2·7</sub>Mn<sub>0.3</sub> experienced less lattice strain during hydrogenation than YNi<sub>2·8</sub>Mn<sub>0.2</sub>.</p></div>","PeriodicalId":378,"journal":{"name":"Journal of Solid State Chemistry","volume":"340 ","pages":"Article 125001"},"PeriodicalIF":3.2,"publicationDate":"2024-09-05","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142149717","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
The impact of halogens on the structural, electronic, and optical properties of vacancy-ordered double perovskites Rb2SeX6 (X=I, Br, Cl) 卤素对空位有序双包晶石 Rb2SeX6(X=I、Br、Cl)的结构、电子和光学特性的影响
IF 3.2 3区 化学
Journal of Solid State Chemistry Pub Date : 2024-09-05 DOI: 10.1016/j.jssc.2024.125002
Hao Zhang , Tianji Ou , Wei Jiang , Xiaomeng Wang , Quan Zhuang , Shuang Feng , Yong Sun , Peifang Li , Xinjun Ma
{"title":"The impact of halogens on the structural, electronic, and optical properties of vacancy-ordered double perovskites Rb2SeX6 (X=I, Br, Cl)","authors":"Hao Zhang ,&nbsp;Tianji Ou ,&nbsp;Wei Jiang ,&nbsp;Xiaomeng Wang ,&nbsp;Quan Zhuang ,&nbsp;Shuang Feng ,&nbsp;Yong Sun ,&nbsp;Peifang Li ,&nbsp;Xinjun Ma","doi":"10.1016/j.jssc.2024.125002","DOIUrl":"10.1016/j.jssc.2024.125002","url":null,"abstract":"<div><p>Lead-based perovskite materials have become one of the most widely used materials in the field of photovoltaics due to their excellent properties. However, concerns over lead toxicity and the stability of materials have prompted the search for alternative, eco-friendly, and stable perovskite materials. To address this need, our study conducts an in-depth analysis of the electronic and optical properties of the lead-free double perovskite materials Rb<sub>2</sub>SeX<sub>6</sub> (X = Cl, Br, I) using first-principles calculations. The results indicate that Rb<sub>2</sub>SeX<sub>6</sub> perovskites possess an indirect bandgap, with values of 3.26 eV, 2.52 eV and 1.39 eV for Rb<sub>2</sub>SeCl<sub>6</sub>/Br<sub>6</sub>/I<sub>6</sub>, respectively. Rb<sub>2</sub>SeI<sub>6</sub> has larger dielectric function and superior absorption spectrum across the visible range than the other two materials. Thus, Rb<sub>2</sub>SeI<sub>6</sub> has a promising future as a photoelectric material for solar cells. Rb<sub>2</sub>SeCl<sub>6</sub> and Rb<sub>2</sub>SeBr<sub>6</sub> also have the potential for use in photodetectors, light-emitting diodes and other optoelectronic devices.</p></div>","PeriodicalId":378,"journal":{"name":"Journal of Solid State Chemistry","volume":"340 ","pages":"Article 125002"},"PeriodicalIF":3.2,"publicationDate":"2024-09-05","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142243343","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Ab-Initio calculations on physical properties of Dirac semimetal AMgBi (A=K, Rb, Cs) 关于狄拉克半金属 AMgBi(A=K、Rb、Cs)物理性质的 Ab-Initio 计算
IF 3.2 3区 化学
Journal of Solid State Chemistry Pub Date : 2024-09-04 DOI: 10.1016/j.jssc.2024.125000
Bahadır Salmankurt
{"title":"Ab-Initio calculations on physical properties of Dirac semimetal AMgBi (A=K, Rb, Cs)","authors":"Bahadır Salmankurt","doi":"10.1016/j.jssc.2024.125000","DOIUrl":"10.1016/j.jssc.2024.125000","url":null,"abstract":"<div><p>This study presents a comprehensive first-principles investigation of the structural, mechanical, vibrational, thermodynamic and electronic properties of AMgBi (A = K, Rb, Cs) compounds using Density Functional Theory. Also, the effect of substituting alkali atoms on the physical properties has been discussed. The tetragonal PbClF-type structure has been confirmed by the analysis and the results revealed good agreement between calculated and experimental lattice parameters for KMgBi. The mechanical properties have been investigated for the first time for RbMgBi and CsMgBi. The mechanical stability of the materials in the ground state has been confirmed through the use of obtained elastic constants. Furthermore, derived parameters from elastic constants such as bulk modulus, shear modulus, and Poisson's ratio indicated that the materials are brittle and exhibited anisotropic mechanical behavior due to their layered structure. This study conducts a detailed analysis of phonon modes, explores their connections to thermal and elastic properties, visualizes the movements of phonon modes at the gamma point, determines Born effective charges, and discusses LO/TO splitting, which is for the first time for RbMgBi and CsMgBi. Phonon dispersion calculations confirmed the dynamical stability of the compounds and revealed the presence of phonon band gaps, supporting their quasi-two-dimensional nature. Investigation of thermodynamic properties using the quasi-harmonic approximation has shown the temperature dependence of internal energy, Helmholtz free energy, specific heat, and entropy for the first time for all compounds. The materials exhibited relatively low thermal conductivity, following the order KMgBi &gt; RbMgBi &gt; CsMgBi. The calculated Grüneisen parameter values were found to be 1.42, 1.44, and 1.53 for KMgBi, RbMgBi, and CsMgBi, respectively, suggesting relatively weak anharmonicity within the materials.</p></div>","PeriodicalId":378,"journal":{"name":"Journal of Solid State Chemistry","volume":"340 ","pages":"Article 125000"},"PeriodicalIF":3.2,"publicationDate":"2024-09-04","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142149715","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
The photophysical properties and structural features of distortion-stabilized K2AuIAuIIIX6 (X = Br, I) double perovskites 畸变稳定的 K2AuIAuIIIX6 (X = Br, I) 双包晶的光物理特性和结构特征
IF 3.2 3区 化学
Journal of Solid State Chemistry Pub Date : 2024-09-04 DOI: 10.1016/j.jssc.2024.124999
Yuansong Ye , Ying Luo , Yange Zhang , Diwen Liu
{"title":"The photophysical properties and structural features of distortion-stabilized K2AuIAuIIIX6 (X = Br, I) double perovskites","authors":"Yuansong Ye ,&nbsp;Ying Luo ,&nbsp;Yange Zhang ,&nbsp;Diwen Liu","doi":"10.1016/j.jssc.2024.124999","DOIUrl":"10.1016/j.jssc.2024.124999","url":null,"abstract":"<div><p>Mixed-valence Cs<sub>2</sub>Au<sup>I</sup>Au<sup>III</sup>X<sub>6</sub> double perovskites (DPs) have aroused great interest because of their high stability and tunable band gap. In this research, the fundamental physical properties and photovoltaic performance of novel K<sub>2</sub>Au<sup>I</sup>Au<sup>III</sup>X<sub>6</sub> (X = Br, I) DPs are thoroughly examined via first-principles calculations. According to our simulations, two highly distorted monoclinic structures are stabilized since their crystal stability is validated. The material ductility is disclosed for both compounds, which makes them suitable for thin-film solar cells. The predicted fundamental band gaps are within 1.0–1.1 eV, implying their potential suitability for efficient solar energy conversion. The optical features such as the optical absorption and photovoltaic performance are comprehensively evaluated. Their optical characteristics are similar to each other, and low reflectivity and energy loss are revealed. Meanwhile, their high solar absorption is undoubtedly observed. Consequently, the simulated conversion efficiencies of 26.1 % and 29.3 % are uncovered for K<sub>2</sub>Au<sup>I</sup>Au<sup>III</sup>Br<sub>6</sub> and K<sub>2</sub>Au<sup>I</sup>Au<sup>III</sup>I<sub>6</sub>, respectively. The discovery of distortion-stabilized K<sub>2</sub>Au<sup>I</sup>Au<sup>III</sup>X<sub>6</sub> DPs can provide an attractive perspective for discovering high-performance optoelectronic materials.</p></div>","PeriodicalId":378,"journal":{"name":"Journal of Solid State Chemistry","volume":"340 ","pages":"Article 124999"},"PeriodicalIF":3.2,"publicationDate":"2024-09-04","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142149716","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Fabrication of lanthanide complexes in metal-organic frameworks as self-calibrating temperature sensor 制备金属有机框架中的镧系元素复合物作为自校准温度传感器
IF 3.2 3区 化学
Journal of Solid State Chemistry Pub Date : 2024-09-03 DOI: 10.1016/j.jssc.2024.124990
Xiu-Zhen Li , Xi-Hui Diao , Jun-Jiang Yan , Na Liu , Yaseen Muhammad , Chao Chen , Hao Wang , Chuan-Song Qi , Wei Li
{"title":"Fabrication of lanthanide complexes in metal-organic frameworks as self-calibrating temperature sensor","authors":"Xiu-Zhen Li ,&nbsp;Xi-Hui Diao ,&nbsp;Jun-Jiang Yan ,&nbsp;Na Liu ,&nbsp;Yaseen Muhammad ,&nbsp;Chao Chen ,&nbsp;Hao Wang ,&nbsp;Chuan-Song Qi ,&nbsp;Wei Li","doi":"10.1016/j.jssc.2024.124990","DOIUrl":"10.1016/j.jssc.2024.124990","url":null,"abstract":"<div><p>Temperature plays an important role as a physical parameter in industry and science, it is crucial to measure temperature accurately. Herein, by “ship-in-a-bottle” strategy, <strong>Ln(phen)</strong> (Ln = Eu<sup>3+</sup>, Tb<sup>3+</sup>; phen = 1,10-phenanthroline) was successfully prepared in one-dimensional pores of <strong>Na–Zn-MOF</strong>. With the lanthanide co-doping approach, <strong>Eu</strong><sub><strong>x</strong></sub><strong>Tb</strong><sub><strong>1-x</strong></sub><strong>(phen)@Na–Zn-MOF</strong> (<strong>3</strong>–<strong>7@Na–Zn-MOF</strong>) were achieved. The luminescent properties of <strong>Eu</strong><sub><strong>x</strong></sub><strong>Tb</strong><sub><strong>1-x</strong></sub><strong>(phen)@Na–Zn-MOF</strong> revealed systematic tuning of their luminescent colors from green, through yellow to red with increasing Eu<sup>3+</sup> doping concentration. Interestingly, two fluorescence emission peaks of <strong>5@Na–Zn-MOF</strong> at 544 nm and 617 nm demonstrate different fluorescence responses to temperature, exhibiting self-calibrating sensor in the range of 293–373 K with the supreme relative sensitivity of 11.02 %·K<sup>−1</sup> at 373 K. Moreover, its luminescent color changes from yellow (293 K) to red (373 K), representing suitable as colorimetric luminescent sensor. Furthermore, <strong>5@Na–Zn-MOF</strong> was blended with poly(vinylidene fluoride) (PVDF) to produce a mixed-matrix membrane (MMM), which also shows excellent temperature response accompanied by color changing.</p></div>","PeriodicalId":378,"journal":{"name":"Journal of Solid State Chemistry","volume":"340 ","pages":"Article 124990"},"PeriodicalIF":3.2,"publicationDate":"2024-09-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142149732","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
[Ce2(H2PO3)(C2O4)4](C6N2H16)·H3O·3H2O: A lanthanide phosphite-oxalate compound with high proton conductivity [Ce2(H2PO3)(C2O4)4](C6N2H16)-H3O-3H2O:一种具有高质子传导性的亚磷酸镧-草酸盐化合物
IF 3.2 3区 化学
Journal of Solid State Chemistry Pub Date : 2024-08-30 DOI: 10.1016/j.jssc.2024.124989
Shanshan Zhao, Liangliang Huang, Yang Lu, Xin Shao, Yue Yuan, Yanfeng Bi
{"title":"[Ce2(H2PO3)(C2O4)4](C6N2H16)·H3O·3H2O: A lanthanide phosphite-oxalate compound with high proton conductivity","authors":"Shanshan Zhao,&nbsp;Liangliang Huang,&nbsp;Yang Lu,&nbsp;Xin Shao,&nbsp;Yue Yuan,&nbsp;Yanfeng Bi","doi":"10.1016/j.jssc.2024.124989","DOIUrl":"10.1016/j.jssc.2024.124989","url":null,"abstract":"<div><p>A new cerium phosphite-oxalate, [Ce<sub>2</sub>(H<sub>2</sub>PO<sub>3</sub>)(C<sub>2</sub>O<sub>4</sub>)<sub>4</sub>](C<sub>6</sub>N<sub>2</sub>H<sub>16</sub>)·H<sub>3</sub>O·3H<sub>2</sub>O (<strong>1</strong>), was prepared under solvothermal condition using 1-ethylpiperazine as template. Single-crystal X-ray diffraction proves that compound <strong>1</strong> has a new three-dimensional (3D) structure constructed with CeO<sub>9</sub> polyhedra, [C<sub>2</sub>O<sub>4</sub><sup>2−</sup>] ligands and [H<sub>2</sub>PO<sub>3</sub><sup>−</sup>] groups. View along the b-axis, 1-ethylpiperazine cations and water molecules alternately located in the adjacent 12-ring channels. Impedance analysis shows that the proton conductivity of <strong>1</strong> is up to 9.17 × 10<sup>−4</sup> S cm<sup>−1</sup> at 75 °C and 98 % relative humidity (RH). Stability test reveals that proton conduction has good persistence at the highest temperature and humidity. This suggests that compound <strong>1</strong> possesses promising proton conductivity property, making it into a potential candidate material for proton exchange membranes.</p></div>","PeriodicalId":378,"journal":{"name":"Journal of Solid State Chemistry","volume":"340 ","pages":"Article 124989"},"PeriodicalIF":3.2,"publicationDate":"2024-08-30","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142162715","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
0
×
引用
GB/T 7714-2015
复制
MLA
复制
APA
复制
导出至
BibTeX EndNote RefMan NoteFirst NoteExpress
×
提示
您的信息不完整,为了账户安全,请先补充。
现在去补充
×
提示
您因"违规操作"
具体请查看互助需知
我知道了
×
提示
确定
请完成安全验证×
相关产品
×
本文献相关产品
联系我们:info@booksci.cn Book学术提供免费学术资源搜索服务,方便国内外学者检索中英文文献。致力于提供最便捷和优质的服务体验。 Copyright © 2023 布克学术 All rights reserved.
京ICP备2023020795号-1
ghs 京公网安备 11010802042870号
Book学术文献互助
Book学术文献互助群
群 号:481959085
Book学术官方微信