Pub Date : 2025-03-14DOI: 10.1007/s10832-025-00387-z
S. K. Sourav, R. N. P. Choudhary, Umakant Prasad
In the present era, the main aim of the researchers is to develop lead-free materials for ferroelectric material devices. Ceramics of perovskite compounds were successfully synthesized using a chemical decomposition method, with the composition (1-x) BiFeO3-x(Bi K)TiMnO3, where x was varied at 0.15 and 0.20. The average crystallite size for BKTM with 15% content and BKTM with 20% content was determined utilizing the Scherrer formula, resulting in 25.34 nm and 24.35 nm, respectively. The confirmation of compound creation was based on the analysis of Crystelloplotic XRD pattern data. The BKTM 15% exhibits an average grain size of 0.41 µm, while BKTM 20% shows 0.40 µm. Energy-dispersive X-ray analysis detected elements such as Bi, Fe, Na, K, Ti, and Mn. Modulus property exploration revealed non-Debye model relaxation behavior, which was observed particularly for sensor technology applications. To investigate the relaxation and conduction mechanisms in these samples were conducted at different temperatures and recurrence. Additionally, the scanning electron microscope (SEM) was employed to examine particle allocation and the location of grain boundaries. Impedance spectroscopic studies covered a wide temperature range (300 K-780 K) and a broad recurrence range (103–106 Hz). Complex plane and Impedance scale are semicircular arcs, which are related to the semiconducting character of the sample.
{"title":"Synthesis and characterization of modified bismuth ferrite (1-x)BiFeO3 -x(BiK)Ti/MnO3, (x = 0.15, 0.20)","authors":"S. K. Sourav, R. N. P. Choudhary, Umakant Prasad","doi":"10.1007/s10832-025-00387-z","DOIUrl":"10.1007/s10832-025-00387-z","url":null,"abstract":"<div><p>In the present era, the main aim of the researchers is to develop lead-free materials for ferroelectric material devices. Ceramics of perovskite compounds were successfully synthesized using a chemical decomposition method, with the composition (1-x) BiFeO<sub>3</sub>-x(Bi K)TiMnO<sub>3</sub>, where x was varied at 0.15 and 0.20. The average crystallite size for BKTM with 15% content and BKTM with 20% content was determined utilizing the Scherrer formula, resulting in 25.34 nm and 24.35 nm, respectively. The confirmation of compound creation was based on the analysis of Crystelloplotic XRD pattern data. The BKTM 15% exhibits an average grain size of 0.41 µm, while BKTM 20% shows 0.40 µm. Energy-dispersive X-ray analysis detected elements such as Bi, Fe, Na, K, Ti, and Mn. Modulus property exploration revealed non-Debye model relaxation behavior, which was observed particularly for sensor technology applications. To investigate the relaxation and conduction mechanisms in these samples were conducted at different temperatures and recurrence. Additionally, the scanning electron microscope (SEM) was employed to examine particle allocation and the location of grain boundaries. Impedance spectroscopic studies covered a wide temperature range (300 K-780 K) and a broad recurrence range (10<sup>3</sup>–10<sup>6</sup> Hz). Complex plane and Impedance scale are semicircular arcs, which are related to the semiconducting character of the sample.</p></div>","PeriodicalId":625,"journal":{"name":"Journal of Electroceramics","volume":"53 3","pages":"293 - 304"},"PeriodicalIF":2.6,"publicationDate":"2025-03-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145100799","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
MgO ceramics with high density and superior properties were prepared from MgO powder using MgF₂ and Al₂O₃ as sintering aids via gelcasting and pressureless sintering. XRD, SEM and EDS were used to analyze the samples. The addition of MgF₂ and Al₂O₃ (with a ratio of Al₂O₃:MgF ₂ = 2–8:4) has been shown to enhance the densification and properties of MgO ceramics. This beneficial liquid phase may be attributed to the synergistic effects of liquid-phase sintering and spinelization reactions, which wet grain boundaries, promote particle rearrangement and mass transport, fill intergranular pores, and accelerate densification. At 1550 °C with an Al₂O₃:MgF ₂ ratio of 6:4, the MgO ceramics achieved optimal values for bulk density (3.331 g/cm3), thermal conductivity (39.2W/(m·K)), and flexural strength (63.15 MPa).
{"title":"Preparation of MgO ceramics by low temperature sintering with MgF2 and Al2O3 as sintering additives","authors":"Yicheng Xiao, Deqing Cheng, Guang Li, Ruiming Yin, Pengfei Li, Zhen Gao","doi":"10.1007/s10832-025-00391-3","DOIUrl":"10.1007/s10832-025-00391-3","url":null,"abstract":"<div><p>MgO ceramics with high density and superior properties were prepared from MgO powder using MgF₂ and Al₂O₃ as sintering aids via gelcasting and pressureless sintering. XRD, SEM and EDS were used to analyze the samples. The addition of MgF₂ and Al₂O₃ (with a ratio of Al₂O₃:MgF ₂ = 2–8:4) has been shown to enhance the densification and properties of MgO ceramics. This beneficial liquid phase may be attributed to the synergistic effects of liquid-phase sintering and spinelization reactions, which wet grain boundaries, promote particle rearrangement and mass transport, fill intergranular pores, and accelerate densification. At 1550 °C with an Al₂O₃:MgF ₂ ratio of 6:4, the MgO ceramics achieved optimal values for bulk density (3.331 g/cm<sup>3</sup>), thermal conductivity (39.2W/(m·K)), and flexural strength (63.15 MPa).</p></div>","PeriodicalId":625,"journal":{"name":"Journal of Electroceramics","volume":"53 3","pages":"281 - 292"},"PeriodicalIF":2.6,"publicationDate":"2025-03-12","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145100797","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Silicon-graphite (Si/Gr) composite anode materials are essential for the advancement of high specific energy lithium-ion batteries (LIBs), yet their performances are often constrained by the interfacial interactions between Si and Gr. In this work, we used ball milling and plasma-assisted ball milling on Gr and nano-sized Si powders, followed by chitosan encapsulation and carbonization to synthesize SG@C and P-SG@C materials, respectively. Our findings indicated that plasma ball milling in an argon atmosphere promotes the exfoliation of Gr while facilitating the intercalation of Si particles within the Gr layers, thereby enhancing encapsulation by chitosan. Compared to SG@C, P-SG@C demonstrates superior initial specific capacity and Coulombic efficiency (CE), achieving a reversible specific capacity of 550.6 mAh/g with a capacity retention of 62.8% after 100 cycles at 0.5 A/g. Furthermore, we observed that the SG@C anodecharacterized by a random arrangement of Si and Gr resulting in degradation. In contrast, P-SG@C demonstrates a concurrent degradation pattern for both components. These observations underscore the advantages of plasma ball milling in optimizing the composite structure of Si and Gr, while highlighting how spatial distribution influences degradation mechanisms affecting anode performance.
硅-石墨(Si/Gr)复合负极材料对高比能锂离子电池(LIBs)的发展至关重要,但其性能往往受到Si和Gr之间界面相互作用的限制。在本研究中,我们对Gr和纳米级Si粉末进行球磨和等离子辅助球磨,然后进行壳聚糖包埋和碳化,分别合成SG@C和P-SG@C材料。研究结果表明,等离子球磨在氩气气氛下促进了Gr的剥离,同时促进了Si颗粒在Gr层内的嵌入,从而增强了壳聚糖的包封性。与SG@C相比,P-SG@C具有更高的初始比容量和库仑效率(CE),在0.5 a /g下循环100次后,其可逆比容量达到550.6 mAh/g,容量保持率为62.8%。此外,我们观察到SG@C阳极的特征是Si和Gr的随机排列导致降解。相反,P-SG@C展示了两个组件的并发退化模式。这些观察结果强调了等离子球磨在优化Si和Gr复合结构方面的优势,同时强调了空间分布如何影响影响阳极性能的降解机制。
{"title":"Regulating spatial distribution of silicon and graphite for high-performance anode materials via plasma-assisted ball milling","authors":"Junjie Peng, Zixiang Yu, Yanmin Yang, Guiyang Xie, Shengyu Wu, Huinan Lin, Yingbin Lin","doi":"10.1007/s10832-025-00388-y","DOIUrl":"10.1007/s10832-025-00388-y","url":null,"abstract":"<div><p>Silicon-graphite (Si/Gr) composite anode materials are essential for the advancement of high specific energy lithium-ion batteries (LIBs), yet their performances are often constrained by the interfacial interactions between Si and Gr. In this work, we used ball milling and plasma-assisted ball milling on Gr and nano-sized Si powders, followed by chitosan encapsulation and carbonization to synthesize SG@C and P-SG@C materials, respectively. Our findings indicated that plasma ball milling in an argon atmosphere promotes the exfoliation of Gr while facilitating the intercalation of Si particles within the Gr layers, thereby enhancing encapsulation by chitosan. Compared to SG@C, P-SG@C demonstrates superior initial specific capacity and Coulombic efficiency (CE), achieving a reversible specific capacity of 550.6 mAh/g with a capacity retention of 62.8% after 100 cycles at 0.5 A/g. Furthermore, we observed that the SG@C anodecharacterized by a random arrangement of Si and Gr resulting in degradation. In contrast, P-SG@C demonstrates a concurrent degradation pattern for both components. These observations underscore the advantages of plasma ball milling in optimizing the composite structure of Si and Gr, while highlighting how spatial distribution influences degradation mechanisms affecting anode performance.</p></div>","PeriodicalId":625,"journal":{"name":"Journal of Electroceramics","volume":"53 2","pages":"257 - 267"},"PeriodicalIF":2.6,"publicationDate":"2025-03-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144914642","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
This study explores the synthesis and characterization of lead-free (1-x)(Bi0.5Na0.5TiO3) – x(KTa0.55Nb0.45O3) (BNT-KTN55) ceramics for their potential for practical energy storage applications, at an electric field < 50 kV/cm. The research addresses the challenge of optimizing relaxor ferroelectric behavior to exhibit a thin P-E loop at this practically relevant electric field. In the study, X-ray diffraction (XRD) and Rietveld refinement confirmed a coexistence of rhombohedral (R3c) and tetragonal (P4bm) phases, with increasing tetragonal phase content as KTN55 doping increased. Scanning Electron Microscopy (SEM) revealed a significant reduction in grain size from 4.34 μm to 0.73 μm. Dielectric measurements showed typical relaxor ferroelectric behavior with frequency-dependent anomalies at Ts, Tm and a flat dielectric response in the range of 75° C to 310° C for higher doping levels. Ferroelectric measurements indicated a steady reduction in remnant polarization (Pr) and coercive field (Ec) with increasing KTN55 content. The composition with x = 0.06 demonstrated optimal performance, with a remnant polarization of 0.96 µC/cm², a maximum polarization of 14.42 µC/cm², and a discharge efficiency of 97.86% under a field of 43 kV/cm. The Recoverable energy density (Wrec) reached 0.295 J/cm³. All of the produced composite samples demonstrated stability without breakdown under the maximum applied electric field of 200 kV/cm, as limited by the instrument. Thus, their breakdown field exceeds this value, qualifying them as high breakdown field ceramics. These results suggest that BNT-KTN55 ceramics, particularly with x = 0.06, is a promising candidate for high-efficiency energy storage applications such as capacitors and pulse power devices.
{"title":"Synthesis and characterization of KTa0.55Nb0.45O3 modified Bi0.5Na0.5TiO3 lead-free Ferroelectric ceramic for energy storage applications","authors":"Vishal Rohilla, Mukesh Kumar, Narayan Singh Panwar","doi":"10.1007/s10832-025-00385-1","DOIUrl":"10.1007/s10832-025-00385-1","url":null,"abstract":"<div><p>This study explores the synthesis and characterization of lead-free (1-<i>x</i>)(Bi<sub>0.5</sub>Na<sub>0.5</sub>TiO<sub>3</sub>) – <i>x</i>(KTa<sub>0.55</sub>Nb<sub>0.45</sub>O<sub>3</sub>) (BNT-KTN55) ceramics for their potential for practical energy storage applications, at an electric field < 50 kV/cm. The research addresses the challenge of optimizing relaxor ferroelectric behavior to exhibit a thin <i>P-E</i> loop at this practically relevant electric field. In the study, X-ray diffraction (XRD) and <i>Rietveld</i> refinement confirmed a coexistence of rhombohedral (<i>R</i>3<i>c</i>) and tetragonal (<i>P</i>4<i>bm</i>) phases, with increasing tetragonal phase content as KTN55 doping increased. Scanning Electron Microscopy (SEM) revealed a significant reduction in grain size from 4.34 μm to 0.73 μm. Dielectric measurements showed typical relaxor ferroelectric behavior with frequency-dependent anomalies at <i>T</i><sub>s</sub>, <i>T</i><sub>m</sub> and a flat dielectric response in the range of 75° C to 310° C for higher doping levels. Ferroelectric measurements indicated a steady reduction in remnant polarization (<i>P</i><sub>r</sub>) and coercive field (<i>E</i><sub><i>c</i></sub>) with increasing KTN55 content. The composition with <i>x</i> = 0.06 demonstrated optimal performance, with a remnant polarization of 0.96 µC/cm², a maximum polarization of 14.42 µC/cm², and a discharge efficiency of 97.86% under a field of 43 kV/cm. The Recoverable energy density (<i>W</i><sub>rec</sub>) reached 0.295 J/cm³. All of the produced composite samples demonstrated stability without breakdown under the maximum applied electric field of 200 kV/cm, as limited by the instrument. Thus, their breakdown field exceeds this value, qualifying them as high breakdown field ceramics. These results suggest that BNT-KTN55 ceramics, particularly with <i>x</i> = 0.06, is a promising candidate for high-efficiency energy storage applications such as capacitors and pulse power devices.</p></div>","PeriodicalId":625,"journal":{"name":"Journal of Electroceramics","volume":"53 2","pages":"243 - 256"},"PeriodicalIF":2.6,"publicationDate":"2025-03-06","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144914585","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2025-03-05DOI: 10.1007/s10832-025-00392-2
Francesca Lo Presti, Anna Lucia Pellegrino, Graziella Malandrino
In the last decades, BaMgF4 based materials represent key systems for several optical applications. The present study explores the optimization of sol-gel conditions for producing pure BaMgF4 thin films on Si (100) substrates by varying precursor ratios and annealing temperatures. Three approaches were examined using different molar ratios of [Ba(hfa)2•tetraglyme] to [Mg(hfa)2•2H2O]•2diglyme. The synthetic method combines sol-gel and spin-coating techniques, utilizing the fluorinated β-diketonate [Ba(hfa)2•tetraglyme] and [Mg(hfa)2•2H2O]•2diglyme as single-source precursors. X-ray diffraction (XRD), energy-dispersive X-ray analysis (EDX), and scanning electron microscopy (SEM) analysis were employed to characterize film composition, crystalline phases, and morphology. The study underscores the critical role of precursor hydrolysis efficiency, with the [Ba(hfa)2•tetraglyme] precursor demonstrating superior performance in producing good-quality BaMgF4 films. These findings provide insights into precise control over precursor chemistry and processing conditions, essential for optimizing film quality and advancing potential applications in optoelectronic devices.
{"title":"Novel sol-gel fabrication of BaMgF4 thin films using single-source alkaline-earth β-diketonate fluorinated compounds","authors":"Francesca Lo Presti, Anna Lucia Pellegrino, Graziella Malandrino","doi":"10.1007/s10832-025-00392-2","DOIUrl":"10.1007/s10832-025-00392-2","url":null,"abstract":"<div><p>In the last decades, BaMgF<sub>4</sub> based materials represent key systems for several optical applications. The present study explores the optimization of sol-gel conditions for producing pure BaMgF<sub>4</sub> thin films on Si (100) substrates by varying precursor ratios and annealing temperatures. Three approaches were examined using different molar ratios of [Ba(hfa)<sub>2</sub>•tetraglyme] to [Mg(hfa)<sub>2</sub>•2H<sub>2</sub>O]•2diglyme. The synthetic method combines sol-gel and spin-coating techniques, utilizing the fluorinated β-diketonate [Ba(hfa)<sub>2</sub>•tetraglyme] and [Mg(hfa)<sub>2</sub>•2H<sub>2</sub>O]•2diglyme as single-source precursors. X-ray diffraction (XRD), energy-dispersive X-ray analysis (EDX), and scanning electron microscopy (SEM) analysis were employed to characterize film composition, crystalline phases, and morphology. The study underscores the critical role of precursor hydrolysis efficiency, with the [Ba(hfa)<sub>2</sub>•tetraglyme] precursor demonstrating superior performance in producing good-quality BaMgF<sub>4</sub> films. These findings provide insights into precise control over precursor chemistry and processing conditions, essential for optimizing film quality and advancing potential applications in optoelectronic devices.</p></div>","PeriodicalId":625,"journal":{"name":"Journal of Electroceramics","volume":"53 2","pages":"233 - 242"},"PeriodicalIF":2.6,"publicationDate":"2025-03-05","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://link.springer.com/content/pdf/10.1007/s10832-025-00392-2.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144914534","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Present work focussed on the preparation and characterization of ferroelectric ceramic-polymer composites, specifically using Poly Vinylidene Fluoride (PVDF) as the polymer host and PbZr0.48Ti0.52O3(PZT), Bi0.5Na0.5TiO3 (BNT) ceramics as the filler. The composites were prepared using the solution casting technique, and various properties were examined under different experimental conditions. The composites were characterized for various properties, including structural, microstructural, vibrational (FTIR-Fourier Transform Infrared), dielectric, and ferroelectric properties. XRD (X-ray Diffraction) analysis was used to observe the electroactive β-phase fraction in the composites. The microstructure of the composites was examined to understand the arrangement of the components. FTIR analysis provided insights into the mechanism of enhancing the β-phase and the interaction between negatively surface-charged ions of the PZT/BNT (BP) filler and the CH2 dipole of the PVDF polymer matrix. Dielectric constant variation with PZT/BNT (BP) filler concentrations was studied. The interplay between functional properties and the β-phase, likely related to ferroelectric behaviour, was discussed in detail. The electroactive β-phase fraction was observed to increase in the ternary composite PVDF/PZT/BNT (BPP). For PVDF/PZT (PP) composite concentration, β-phase fraction decreased because of percolation effect. The study explores the comprehensive characterization of ferroelectric ceramic-polymer composites, focusing on the interaction between the polymer matrix and piezoceramic (PZT/BNT) (BP) filler. The observed changes in properties, especially the electroactive β-phase fraction, provide valuable insights into the composition-structure-property relationships in these composites. The work sheds light on the potential applications and optimization of these composites for capacitive applications.
{"title":"Enhancing the β-phase of PVDF by nano piezoceramic hybrid for advanced capacitive and energy storage application","authors":"Shraddha Joshi, Smita Acharya, Shahin Sayyad, Shraddha Shirbhate, Tanveer Quazi, Neha Dorle","doi":"10.1007/s10832-025-00390-4","DOIUrl":"10.1007/s10832-025-00390-4","url":null,"abstract":"<div><p>Present work focussed on the preparation and characterization of ferroelectric ceramic-polymer composites, specifically using Poly Vinylidene Fluoride (PVDF) as the polymer host and PbZr<sub>0.48</sub>Ti<sub>0.52</sub>O<sub>3</sub>(PZT), Bi<sub>0.5</sub>Na<sub>0.5</sub>TiO<sub>3</sub> (BNT) ceramics as the filler. The composites were prepared using the solution casting technique, and various properties were examined under different experimental conditions. The composites were characterized for various properties, including structural, microstructural, vibrational (FTIR-Fourier Transform Infrared), dielectric, and ferroelectric properties. XRD (X-ray Diffraction) analysis was used to observe the electroactive β-phase fraction in the composites. The microstructure of the composites was examined to understand the arrangement of the components. FTIR analysis provided insights into the mechanism of enhancing the β-phase and the interaction between negatively surface-charged ions of the PZT/BNT (BP) filler and the CH<sub>2</sub> dipole of the PVDF polymer matrix. Dielectric constant variation with PZT/BNT (BP) filler concentrations was studied. The interplay between functional properties and the β-phase, likely related to ferroelectric behaviour, was discussed in detail. The electroactive β-phase fraction was observed to increase in the ternary composite PVDF/PZT/BNT (BPP). For PVDF/PZT (PP) composite concentration, β-phase fraction decreased because of percolation effect. The study explores the comprehensive characterization of ferroelectric ceramic-polymer composites, focusing on the interaction between the polymer matrix and piezoceramic (PZT/BNT) (BP) filler. The observed changes in properties, especially the electroactive β-phase fraction, provide valuable insights into the composition-structure-property relationships in these composites. The work sheds light on the potential applications and optimization of these composites for capacitive applications.</p></div>","PeriodicalId":625,"journal":{"name":"Journal of Electroceramics","volume":"53 2","pages":"223 - 232"},"PeriodicalIF":2.6,"publicationDate":"2025-02-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144914717","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2025-02-25DOI: 10.1007/s10832-025-00389-x
Yanan Du, Zhiqiang Huang, Maoxin Yu, Zhilong Wu, Xiaohui Huang, Shaoming Ying, Haotian Yang, Zhiya Lin
The natural abundance and potential cost benefits of sodium-ion batteries (SIBs) and potassium-ion batteries (PIBs) make them increasingly appealing as viable substitutes to lithium-ion batteries (LIBs). Nonetheless, the progress of PIBs and SIBs is significantly hindered by the limited poor rate capability and mediocre cycling durability attributed to the huger ionic radius of K+ and Na+ in comparison to Li+. Herein, MoO2/N-doped carbon nanoribbons with rich oxygen vacancies (OVs) have been prepared via hydrothermal method followed by thermal annealing in Ar atmosphere. The composite nanoribbons, as novel anode materials, demonstrate excellent electrochemical performance with a specific capacity of 132.6 mAh g− 1 at 5 A g− 1 for SIBs and 130.2 mAh g− 1 at 1 A g− 1 for PIBs, along with a high Coulombic efficiency of approximately 100% over 2000 cycles for SIBs and 10,000 cycles for PIBs. The highly conductive N-doped carbon significantly facilitates electron transfer, effectively suppress volume expansion, and increase additional sodium and potassium storage sites. A built-in electric field at heterojunction interface is beneficial for Na/K ions diffusion across the interface. Novelty, the rich OVs in MoO2 lattices could induce built-in electric field around localized oxygen-vacancies, accelerating the migration of Na/K ions based on built-in electric field (BIEF) and percolation-channel model.
钠离子电池(SIBs)和钾离子电池(PIBs)的天然丰度和潜在的成本效益使它们作为锂离子电池(lib)的可行替代品越来越有吸引力。然而,与Li+相比,K+和Na+的离子半径更大,导致pib和sib的速率能力有限,循环耐久性一般,这严重阻碍了pib和sib的进展。本文采用水热法制备了具有富氧空位(OVs)的MoO2/ n掺杂碳纳米带,并在Ar气氛中进行了热退火。复合纳米带作为新型负极材料,具有优异的电化学性能,SIBs在5 a g−1时的比容量为132.6 mAh g−1,PIBs在1 a g−1时的比容量为130.2 mAh g−1,SIBs在2000次循环中具有约100%的库仑效率,PIBs在10,000次循环中具有约100%的库仑效率。高导电性n掺杂碳显著促进电子转移,有效抑制体积膨胀,并增加额外的钠和钾存储位点。异质结界面上的内置电场有利于Na/K离子在界面上的扩散。新颖的是,MoO2晶格中丰富的OVs可以在局部氧空位周围产生内建电场,加速Na/K离子的迁移,基于内建电场和渗透通道模型。
{"title":"Rich oxygen vacancies promotes MoO2/N-doped carbon nanoribbons for high-performance sodium/potassium-ion batteries","authors":"Yanan Du, Zhiqiang Huang, Maoxin Yu, Zhilong Wu, Xiaohui Huang, Shaoming Ying, Haotian Yang, Zhiya Lin","doi":"10.1007/s10832-025-00389-x","DOIUrl":"10.1007/s10832-025-00389-x","url":null,"abstract":"<div><p>The natural abundance and potential cost benefits of sodium-ion batteries (SIBs) and potassium-ion batteries (PIBs) make them increasingly appealing as viable substitutes to lithium-ion batteries (LIBs). Nonetheless, the progress of PIBs and SIBs is significantly hindered by the limited poor rate capability and mediocre cycling durability attributed to the huger ionic radius of K<sup>+</sup> and Na<sup>+</sup> in comparison to Li<sup>+</sup>. Herein, MoO<sub>2</sub>/N-doped carbon nanoribbons with rich oxygen vacancies (OVs) have been prepared via hydrothermal method followed by thermal annealing in Ar atmosphere. The composite nanoribbons, as novel anode materials, demonstrate excellent electrochemical performance with a specific capacity of 132.6 mAh g<sup>− 1</sup> at 5 A g<sup>− 1</sup> for SIBs and 130.2 mAh g<sup>− 1</sup> at 1 A g<sup>− 1</sup> for PIBs, along with a high Coulombic efficiency of approximately 100% over 2000 cycles for SIBs and 10,000 cycles for PIBs. The highly conductive N-doped carbon significantly facilitates electron transfer, effectively suppress volume expansion, and increase additional sodium and potassium storage sites. A built-in electric field at heterojunction interface is beneficial for Na/K ions diffusion across the interface. Novelty, the rich OVs in MoO<sub>2</sub> lattices could induce built-in electric field around localized oxygen-vacancies, accelerating the migration of Na/K ions based on built-in electric field (BIEF) and percolation-channel model.</p></div>","PeriodicalId":625,"journal":{"name":"Journal of Electroceramics","volume":"53 2","pages":"212 - 222"},"PeriodicalIF":2.6,"publicationDate":"2025-02-25","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144914626","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
The development of high-performance silicon/silicon oxide (Si/SiOx) anodes has attracted great attention in the field of next-generation high-energy lithium-ion batteries (LIBs). However, preparing effective Si/SiOx composite materials to address issues such as poor cycling stability, subpar initial coulombic efficiency (ICE), and subpar interface compatibility remains a challenge. This work proposes a simple strategy for preparing Fe/Fe3C particle modified thin-layer carbon-coated Si/SiOx composite materials using a mixture of resorcinol formaldehyde (RF) precursor pyrolysis and ultrasonic treatment (referred to as C@Si/SiOx-Fe/Fe3C, abbreviated as CSSO-Fe/Fe3C). These composite materials are used as anodes for LIBs. Exploiting the benefits of its structure and composition, the CSSO-Fe/Fe3C anode offers a high ICE value of 68.7% and maintains a capacity of 563.2 mAh g−1 even after 1200 cycles at a current density of 2.5 A g−1. Comprehensive characterization and electrochemical studies have elucidated the interface compatibility and structural stability mechanisms induced by the small amount of Fe/Fe3C doping and carbon coating, which explain the high capacity and stable cycling performance. Furthermore, when paired with LiCoO2 cathode, the assembled LiCoO2||CSSO-Fe/Fe3C coin-type full battery has a capacity of 80.7 mAh g−1 and a capacity retention rate of 76.6% after 200 cycles at 1.0 C. This synthesis approach offers valuable insights for designing high-performance Si/SiOx electrode materials.
高性能硅/氧化硅(Si/SiOx)阳极的开发是下一代高能锂离子电池(LIBs)领域的研究热点。然而,制备有效的Si/SiOx复合材料以解决循环稳定性差、初始库仑效率(ICE)欠佳和界面相容性欠佳等问题仍然是一个挑战。本工作提出了一种简单的策略,利用间苯二酚甲醛(RF)前体热解和超声波处理的混合物制备Fe/Fe3C颗粒改性薄层碳包覆Si/SiOx复合材料(简称C@Si/SiOx-Fe/Fe3C,简称CSSO-Fe/Fe3C)。这些复合材料被用作lib的阳极。利用其结构和组成的优势,CSSO-Fe/Fe3C阳极提供了68.7%的高ICE值,并且在电流密度为2.5 a g−1的情况下,即使在1200次循环后仍保持563.2 mAh g−1的容量。综合表征和电化学研究阐明了少量Fe/Fe3C掺杂和碳包覆诱导的界面相容性和结构稳定性机制,从而解释了高容量和稳定的循环性能。此外,当与LiCoO2阴极配合时,组装的LiCoO2||CSSO-Fe/Fe3C硬币型全电池在1.0℃下循环200次后的容量为80.7 mAh g−1,容量保持率为76.6%。该合成方法为设计高性能Si/SiOx电极材料提供了有价值的见解。
{"title":"Fe/Fe3C modified C@Si/SiOx anodes to achieve significantly enhanced lithium storage performance","authors":"Cheng Lin, Yuchan He, Wuyi Zhuang, Sili Chen, Zhixian You, Guiying Zhao, Zhigao Huang, Jiaxin Li","doi":"10.1007/s10832-025-00386-0","DOIUrl":"10.1007/s10832-025-00386-0","url":null,"abstract":"<div><p>The development of high-performance silicon/silicon oxide (Si/SiO<sub>x</sub>) anodes has attracted great attention in the field of next-generation high-energy lithium-ion batteries (LIBs). However, preparing effective Si/SiO<sub>x</sub> composite materials to address issues such as poor cycling stability, subpar initial coulombic efficiency (ICE), and subpar interface compatibility remains a challenge. This work proposes a simple strategy for preparing Fe/Fe<sub>3</sub>C particle modified thin-layer carbon-coated Si/SiO<sub>x</sub> composite materials using a mixture of resorcinol formaldehyde (RF) precursor pyrolysis and ultrasonic treatment (referred to as C@Si/SiO<sub>x</sub>-Fe/Fe<sub>3</sub>C, abbreviated as CSSO-Fe/Fe<sub>3</sub>C). These composite materials are used as anodes for LIBs. Exploiting the benefits of its structure and composition, the CSSO-Fe/Fe<sub>3</sub>C anode offers a high ICE value of 68.7% and maintains a capacity of 563.2 mAh g<sup>−1</sup> even after 1200 cycles at a current density of 2.5 A g<sup>−1</sup>. Comprehensive characterization and electrochemical studies have elucidated the interface compatibility and structural stability mechanisms induced by the small amount of Fe/Fe<sub>3</sub>C doping and carbon coating, which explain the high capacity and stable cycling performance. Furthermore, when paired with LiCoO<sub>2</sub> cathode, the assembled LiCoO<sub>2</sub>||CSSO-Fe/Fe<sub>3</sub>C coin-type full battery has a capacity of 80.7 mAh g<sup>−1</sup> and a capacity retention rate of 76.6% after 200 cycles at 1.0 C. This synthesis approach offers valuable insights for designing high-performance Si/SiO<sub>x</sub> electrode materials.</p></div>","PeriodicalId":625,"journal":{"name":"Journal of Electroceramics","volume":"53 2","pages":"199 - 211"},"PeriodicalIF":2.6,"publicationDate":"2025-02-17","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144914712","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2025-01-17DOI: 10.1007/s10832-025-00382-4
A. Jabar, S. Idrissi, L. Bahmad
This study presents a comprehensive investigation of the structural, electronic, optical, thermodynamic, and thermoelectric properties of the halide double perovskite Cs2CeCl6 using density functional theory (DFT) with the LSDA + mBJ approach in the Wien2k package. Our work is the first to explore the electronic properties of Cs2CeCl6, identifying it as a p-type semiconductor with a band gap of approximately 1.828 eV. Optical analysis reveals strong absorption in the UV-visible range, with a detailed evaluation of the absorption coefficient, electron energy loss, refractive index, extinction coefficient, and the real and imaginary parts of the dielectric tensor and optical conductivity. The observed increase in Debye temperature under pressure suggests enhanced thermal conductivity, crucial for understanding its behavior under varying conditions. Thermoelectric analysis shows that the figure of merit (ZT) improves with higher Seebeck coefficients and electrical conductivity but decreases with increasing thermal conductivity, illustrating the delicate balance needed to optimize thermoelectric performance.
{"title":"A DFT study of the structural, electronic, optical, thermoelectric, and thermodynamic properties of the halide double perovskite Cs2CeCl6","authors":"A. Jabar, S. Idrissi, L. Bahmad","doi":"10.1007/s10832-025-00382-4","DOIUrl":"10.1007/s10832-025-00382-4","url":null,"abstract":"<div><p>This study presents a comprehensive investigation of the structural, electronic, optical, thermodynamic, and thermoelectric properties of the halide double perovskite Cs<sub>2</sub>CeCl<sub>6</sub> using density functional theory (DFT) with the LSDA + mBJ approach in the Wien2k package. Our work is the first to explore the electronic properties of Cs<sub>2</sub>CeCl<sub>6</sub>, identifying it as a p-type semiconductor with a band gap of approximately 1.828 eV. Optical analysis reveals strong absorption in the UV-visible range, with a detailed evaluation of the absorption coefficient, electron energy loss, refractive index, extinction coefficient, and the real and imaginary parts of the dielectric tensor and optical conductivity. The observed increase in Debye temperature under pressure suggests enhanced thermal conductivity, crucial for understanding its behavior under varying conditions. Thermoelectric analysis shows that the figure of merit (ZT) improves with higher Seebeck coefficients and electrical conductivity but decreases with increasing thermal conductivity, illustrating the delicate balance needed to optimize thermoelectric performance.</p></div>","PeriodicalId":625,"journal":{"name":"Journal of Electroceramics","volume":"53 2","pages":"186 - 198"},"PeriodicalIF":2.6,"publicationDate":"2025-01-17","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144914751","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2025-01-14DOI: 10.1007/s10832-025-00383-3
Sajeel Khan, Muhammad Atif Yaqub, Saima Alam, Muhammad Zeeshan, Abdul Quader, Shahid M. Ramay, Shahid Atiq
Recently, perovskite materials have drawn the attention of researchers due to their promising properties in energy conversion and energy storage applications. In this work, we reported Co-substituted Ca2Mn2O5 perovskite, revealing a fast-switching response and efficient energy storage capability. The samples were synthesized using the sol − gel auto-combustion technique. Structural analysis confirms the orthorhombic crystal structure of the material. Because of the smaller ionic radii of Co+ 3, the lattice parameters marginally decreased as Co-substitution increased. Field emission scanning electron microscopy revealed the non-homogenous distributed grains of roughly spherical shape. The P-E loop analysis showed the maximum polarization for the specimen with x = 0.16 with an electric field of 100 V/cm. Moreover, the maximum recoverable energy storage density and maximum efficiency were also observed for the specimen with x = 0.16. Electrical conductivity, I-V characteristics, and fast switching capability were also investigated in our work. I-V characteristic displayed the gradual increase in current with the increment of substitution contents. This study unwrapped the potential of this material for application in energy storage, data storage, and fast-switching electronic applications.
{"title":"Efficient energy storage and fast charge-switching capability in Co-substituted Ca2Mn2O5 perovskites","authors":"Sajeel Khan, Muhammad Atif Yaqub, Saima Alam, Muhammad Zeeshan, Abdul Quader, Shahid M. Ramay, Shahid Atiq","doi":"10.1007/s10832-025-00383-3","DOIUrl":"10.1007/s10832-025-00383-3","url":null,"abstract":"<div><p>Recently, perovskite materials have drawn the attention of researchers due to their promising properties in energy conversion and energy storage applications. In this work, we reported Co-substituted Ca<sub>2</sub>Mn<sub>2</sub>O<sub>5</sub> perovskite, revealing a fast-switching response and efficient energy storage capability. The samples were synthesized using the sol − gel auto-combustion technique. Structural analysis confirms the orthorhombic crystal structure of the material. Because of the smaller ionic radii of Co<sup>+ 3</sup>, the lattice parameters marginally decreased as Co-substitution increased. Field emission scanning electron microscopy revealed the non-homogenous distributed grains of roughly spherical shape. The P-E loop analysis showed the maximum polarization for the specimen with x = 0.16 with an electric field of 100 V/cm. Moreover, the maximum recoverable energy storage density and maximum efficiency were also observed for the specimen with x = 0.16. Electrical conductivity, I-V characteristics, and fast switching capability were also investigated in our work. I-V characteristic displayed the gradual increase in current with the increment of substitution contents. This study unwrapped the potential of this material for application in energy storage, data storage, and fast-switching electronic applications.</p></div>","PeriodicalId":625,"journal":{"name":"Journal of Electroceramics","volume":"53 2","pages":"176 - 185"},"PeriodicalIF":2.6,"publicationDate":"2025-01-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144914701","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}