Jifeng Yang, Lianfeng Yan, Lideng Ye, Guangheng Xiao, Kaige Wang, Yuling Liu, Ligang Zhang, Libin Liu, Yong Du
The K2O-Al2O3-SiO2 system is an important component of microcrystalline glass. The K2O-Al2O3 and K2O-SiO2 binary systems and the K2O-Al2O3-SiO2 ternary system were thermodynamically evaluated and optimized using the CALculation of PHAse Diagram (CALPHAD) method. The liquid phase is described by using the ionic two-sublattice model, and the solid solutions involved in the ternary system are all described using the compound energy formalism (CEF) model. The new parameters obtained from the optimization are capable of describing the equilibrium phase relations of the ternary system and its subsystems, and the calculated thermodynamic properties of the ternary compounds are in good agreement with the experimental data.
K2O-Al2O3-SiO2 系统是微晶玻璃的重要组成部分。利用CALculation of PHAse Diagram(CALPHAD)方法对K2O-Al2O3和K2O-SiO2二元体系以及K2O-Al2O3-SiO2三元体系进行了热力学评估和优化。液相采用离子双亚晶格模型进行描述,三元体系中涉及的固溶体均采用复能形式主义(CEF)模型进行描述。优化得到的新参数能够描述三元体系及其子体系的平衡相关系,计算得到的三元化合物热力学性质与实验数据吻合良好。
{"title":"Thermodynamic evaluation and optimization of the K2O-Al2O3-SiO2 system","authors":"Jifeng Yang, Lianfeng Yan, Lideng Ye, Guangheng Xiao, Kaige Wang, Yuling Liu, Ligang Zhang, Libin Liu, Yong Du","doi":"10.1111/jace.20093","DOIUrl":"10.1111/jace.20093","url":null,"abstract":"<p>The K<sub>2</sub>O-Al<sub>2</sub>O<sub>3</sub>-SiO<sub>2</sub> system is an important component of microcrystalline glass. The K<sub>2</sub>O-Al<sub>2</sub>O<sub>3</sub> and K<sub>2</sub>O-SiO<sub>2</sub> binary systems and the K<sub>2</sub>O-Al<sub>2</sub>O<sub>3</sub>-SiO<sub>2</sub> ternary system were thermodynamically evaluated and optimized using the CALculation of PHAse Diagram (CALPHAD) method. The liquid phase is described by using the ionic two-sublattice model, and the solid solutions involved in the ternary system are all described using the compound energy formalism (CEF) model. The new parameters obtained from the optimization are capable of describing the equilibrium phase relations of the ternary system and its subsystems, and the calculated thermodynamic properties of the ternary compounds are in good agreement with the experimental data.</p>","PeriodicalId":200,"journal":{"name":"Journal of the American Ceramic Society","volume":"107 12","pages":"8732-8745"},"PeriodicalIF":3.5,"publicationDate":"2024-08-22","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142198291","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
In this study, the influence of foreign and native point defects in magnesium oxide on the sintering process is examined. We have introduced dopants into magnesium oxide, with cations that share similar sizes but possess varying charges to minimize the direct impact of strain. The selected foreign cations were as follows: (1) Li1+, an acceptor that enhances the concentration of oxygen vacancies; (2) Sc3+, a donor that enhances the concentration of magnesium (metal) vacancies; and (3) Zn2+, an isovalent dopant. The results reveal that oxygen vacancies introduced by lithium doping greatly decrease the sintering temperature of magnesium oxide compared to the magnesium vacancies’ effect (scandium doping). Zinc doping was found to increase the surface oxygen vacancies with only a minor effect on the sintering temperature. Enhancing the oxygen vacancy concentration by lithium doping creates an additional mechanism for sintering because the anion sublattice is the backbone of the material, and oxygen ion diffusion is the rate-limiting step. Scandium doping also has a sintering–promoting effect, yet a minor one. The doping factor analysis is considered and implies that aliovalent dopants do not affect the concentration of the fast-diffusing species, which are native vacancy associates.
{"title":"The influence of point defects on the sintering of magnesium oxide","authors":"Rawan Halabi, Sasha Simotko, Yoed Tsur","doi":"10.1111/jace.20090","DOIUrl":"10.1111/jace.20090","url":null,"abstract":"<p>In this study, the influence of foreign and native point defects in magnesium oxide on the sintering process is examined. We have introduced dopants into magnesium oxide, with cations that share similar sizes but possess varying charges to minimize the direct impact of strain. The selected foreign cations were as follows: (1) Li<sup>1+</sup>, an acceptor that enhances the concentration of oxygen vacancies; (2) Sc<sup>3+</sup>, a donor that enhances the concentration of magnesium (metal) vacancies; and (3) Zn<sup>2+</sup>, an isovalent dopant. The results reveal that oxygen vacancies introduced by lithium doping greatly decrease the sintering temperature of magnesium oxide compared to the magnesium vacancies’ effect (scandium doping). Zinc doping was found to increase the surface oxygen vacancies with only a minor effect on the sintering temperature. Enhancing the oxygen vacancy concentration by lithium doping creates an <i>additional mechanism</i> for sintering because the anion sublattice is the backbone of the material, and oxygen ion diffusion is the rate-limiting step. Scandium doping also has a sintering–promoting effect, yet a minor one. The doping factor analysis is considered and implies that aliovalent dopants do not affect the concentration of the fast-diffusing species, which are native vacancy associates.</p>","PeriodicalId":200,"journal":{"name":"Journal of the American Ceramic Society","volume":"107 12","pages":"8023-8035"},"PeriodicalIF":3.5,"publicationDate":"2024-08-21","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://onlinelibrary.wiley.com/doi/epdf/10.1111/jace.20090","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142198337","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Haoran Zou, Wen Zhang, Jinyong Zhang, Lin Ren, Weimin Wang, Fan Zhang, Bin Li, Zhengyi Fu
High-performance MAX phase-based composites were developed to overcome the inherent low hardness and low strength of MAX phases by combining lattice distortion-induced strengthening, texture strengthening, and second-phase particle strengthening. Textured high-entropy M4AlC3/Al2O3 (M = Ti, V, Mo, Nb, Ta) composites with different Al2O3 contents were prepared using spark plasma sintering at 1350°C for 70 min. The microstructures of all samples with different compositions were characterized in detail. It was found that as the Al2O3 content increased, the grain size of the high-entropy M4AlC3 phase gradually decreased, and the aggregation of Al2O3 became more severe. Based on this, the density, hardness, strength, and fracture toughness of all composites were tested. The results indicate that all textured composites exhibit significant anisotropy in their properties, with the high-entropy M4AlC3/15 vol%Al2O3 composite showing the best overall performance. Additionally, the mechanism of performance improvement was systematically discussed. This work provides an important reference for the subsequent preparation of high-performance MAX phase-based composites.
通过结合晶格畸变诱导强化、纹理强化和第二相颗粒强化,开发了基于 MAX 相的高性能复合材料,以克服 MAX 相固有的低硬度和低强度问题。采用 1350°C 下 70 分钟的火花等离子烧结法制备了不同 Al2O3 含量的纹理高熵 M4AlC3/Al2O3(M = Ti、V、Mo、Nb、Ta)复合材料。对不同成分的所有样品的微观结构进行了详细表征。研究发现,随着 Al2O3 含量的增加,高熵 M4AlC3 相的晶粒尺寸逐渐减小,Al2O3 的聚集现象变得更加严重。在此基础上,测试了所有复合材料的密度、硬度、强度和断裂韧性。结果表明,所有纹理复合材料的性能都表现出明显的各向异性,其中高熵 M4AlC3/15 vol%Al2O3 复合材料的综合性能最好。此外,还系统地讨论了性能改善的机理。这项工作为后续制备高性能 MAX 相基复合材料提供了重要参考。
{"title":"Microstructure and mechanical properties of textured high-entropy M₄AlC₃/Al₂O₃ (M = Ti, V, Mo, Nb, Ta) composites","authors":"Haoran Zou, Wen Zhang, Jinyong Zhang, Lin Ren, Weimin Wang, Fan Zhang, Bin Li, Zhengyi Fu","doi":"10.1111/jace.20082","DOIUrl":"10.1111/jace.20082","url":null,"abstract":"<p>High-performance MAX phase-based composites were developed to overcome the inherent low hardness and low strength of MAX phases by combining lattice distortion-induced strengthening, texture strengthening, and second-phase particle strengthening. Textured high-entropy M<sub>4</sub>AlC<sub>3</sub>/Al<sub>2</sub>O<sub>3</sub> (M = Ti, V, Mo, Nb, Ta) composites with different Al<sub>2</sub>O<sub>3</sub> contents were prepared using spark plasma sintering at 1350°C for 70 min. The microstructures of all samples with different compositions were characterized in detail. It was found that as the Al<sub>2</sub>O<sub>3</sub> content increased, the grain size of the high-entropy M<sub>4</sub>AlC<sub>3</sub> phase gradually decreased, and the aggregation of Al<sub>2</sub>O<sub>3</sub> became more severe. Based on this, the density, hardness, strength, and fracture toughness of all composites were tested. The results indicate that all textured composites exhibit significant anisotropy in their properties, with the high-entropy M<sub>4</sub>AlC<sub>3</sub>/15 vol%Al<sub>2</sub>O<sub>3</sub> composite showing the best overall performance. Additionally, the mechanism of performance improvement was systematically discussed. This work provides an important reference for the subsequent preparation of high-performance MAX phase-based composites.</p>","PeriodicalId":200,"journal":{"name":"Journal of the American Ceramic Society","volume":"107 12","pages":"8490-8502"},"PeriodicalIF":3.5,"publicationDate":"2024-08-21","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142198416","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Lead-based piezo-ceramics like lead zirconate titanate (PZT) are a mainstay for many piezoelectric applications. However, lead oxide (PbO) evaporation during sintering poses a significant environmental challenge. Flash sintering (FS) is a novel technique that can densify ceramics in seconds and at a much lower furnace temperature. The liquid-phase FS (LPFS) of PZT (Pb (Zr0.5Ti0.5) O3, with 3 wt.% Cu2O and PbO in the molar ratio of 1:4) is investigated in this work. Further, a comparison has been made among the lead loss, dielectric, and piezoelectric properties of flash-sintered and conventionally liquid-phase-sintered PZT. It has been observed that the evaporation of PbO has been brought down 3–5 times by FS. The dielectric constant of LPFS PZT is significantly higher, especially at higher frequencies with lower dielectric loss. An enhanced piezoelectric coefficient in flash-sintered PZT has also been observed. The LPFS of PZT shows that the lead loss can be brought down significantly with the added benefit of enhanced dielectric and piezoelectric properties. XRD and Rietveld analysis show an increase in tetragonality after FS in comparison with conventional sintering. XPS and ESR studies show a difference in defect concentration after FS in comparison with conventional sintering that is likely responsible for the enhanced dielectric and piezoelectric properties.
{"title":"Novel liquid–phase flash sintering of lead zirconate titanate piezo-ceramics","authors":"Kumar Sadanand Arya, Ram Prakash Singh, Tamoghna Chakrabarti","doi":"10.1111/jace.20075","DOIUrl":"10.1111/jace.20075","url":null,"abstract":"<p>Lead-based piezo-ceramics like lead zirconate titanate (PZT) are a mainstay for many piezoelectric applications. However, lead oxide (PbO) evaporation during sintering poses a significant environmental challenge. Flash sintering (FS) is a novel technique that can densify ceramics in seconds and at a much lower furnace temperature. The liquid-phase FS (LPFS) of PZT (Pb (Zr<sub>0.5</sub>Ti<sub>0.5</sub>) O<sub>3</sub>, with 3 wt.% Cu<sub>2</sub>O and PbO in the molar ratio of 1:4) is investigated in this work. Further, a comparison has been made among the lead loss, dielectric, and piezoelectric properties of flash-sintered and conventionally liquid-phase-sintered PZT. It has been observed that the evaporation of PbO has been brought down 3–5 times by FS. The dielectric constant of LPFS PZT is significantly higher, especially at higher frequencies with lower dielectric loss. An enhanced piezoelectric coefficient in flash-sintered PZT has also been observed. The LPFS of PZT shows that the lead loss can be brought down significantly with the added benefit of enhanced dielectric and piezoelectric properties. XRD and Rietveld analysis show an increase in tetragonality after FS in comparison with conventional sintering. XPS and ESR studies show a difference in defect concentration after FS in comparison with conventional sintering that is likely responsible for the enhanced dielectric and piezoelectric properties.</p>","PeriodicalId":200,"journal":{"name":"Journal of the American Ceramic Society","volume":"107 12","pages":"8007-8022"},"PeriodicalIF":3.5,"publicationDate":"2024-08-21","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142198333","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}