{"title":"The effect of Mo and Sc dopants on the performance of an Sr2Fe2O6 cathode for use in proton-conducting solid oxide fuel cells","authors":"Shu Yang, Yueyuan Gu, Shoufu Yu","doi":"10.1016/j.mseb.2024.117836","DOIUrl":null,"url":null,"abstract":"<div><div>Sr<sub>2</sub>Fe<sub>2</sub>O<sub>6</sub> was doped with Sc and Mo ions to investigate the effect of these dopants on the material properties and cathode performance. Both Sc and Mo were doped into Sr<sub>2</sub>Fe<sub>2</sub>O<sub>6</sub> as pure phases, and the thermal expansion coefficient (TEC) increased with the Sc content of the material. A first-principles calculation at the atomic level indicated that Mo facilitated hydration, whereas Sc doping facilitated the formation of oxygen vacancies. Simulation results showed that the lowest energy barrier to O<sub>2</sub> adsorption and dissociation was obtained by co-doping Sc and Mo into Sr<sub>2</sub>Fe<sub>2</sub>O<sub>6</sub>, facilitating the cathode reaction. The results of fuel cell tests indicated that co-doping with Sc and Mo resulted in higher fuel-cell performance for Sr<sub>2</sub>Fe<sub>2</sub>O<sub>6</sub> than doping with Sc or Mo alone. An impedance analysis for Sr<sub>2</sub>Fe<sub>2</sub>O<sub>6</sub> co-doped with Sc and Mo indicated a good balance between hydration and oxygen vacancy formation, as well as a low energy barrier to O<sub>2</sub> adsorption and dissociation, which resulted in this material exhibiting the lowest polarization resistance among the tested cathodes. This study demonstrates that each dopant has unique advantages and disadvantages in terms of cathode properties, and it is necessary to strike a balance among the parameters involved to enhance the cathode performance.</div></div>","PeriodicalId":18233,"journal":{"name":"Materials Science and Engineering B-advanced Functional Solid-state Materials","volume":"311 ","pages":"Article 117836"},"PeriodicalIF":3.9000,"publicationDate":"2024-11-16","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Materials Science and Engineering B-advanced Functional Solid-state Materials","FirstCategoryId":"88","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S0921510724006652","RegionNum":3,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q2","JCRName":"MATERIALS SCIENCE, MULTIDISCIPLINARY","Score":null,"Total":0}
引用次数: 0
Abstract
Sr2Fe2O6 was doped with Sc and Mo ions to investigate the effect of these dopants on the material properties and cathode performance. Both Sc and Mo were doped into Sr2Fe2O6 as pure phases, and the thermal expansion coefficient (TEC) increased with the Sc content of the material. A first-principles calculation at the atomic level indicated that Mo facilitated hydration, whereas Sc doping facilitated the formation of oxygen vacancies. Simulation results showed that the lowest energy barrier to O2 adsorption and dissociation was obtained by co-doping Sc and Mo into Sr2Fe2O6, facilitating the cathode reaction. The results of fuel cell tests indicated that co-doping with Sc and Mo resulted in higher fuel-cell performance for Sr2Fe2O6 than doping with Sc or Mo alone. An impedance analysis for Sr2Fe2O6 co-doped with Sc and Mo indicated a good balance between hydration and oxygen vacancy formation, as well as a low energy barrier to O2 adsorption and dissociation, which resulted in this material exhibiting the lowest polarization resistance among the tested cathodes. This study demonstrates that each dopant has unique advantages and disadvantages in terms of cathode properties, and it is necessary to strike a balance among the parameters involved to enhance the cathode performance.
期刊介绍:
The journal provides an international medium for the publication of theoretical and experimental studies and reviews related to the electronic, electrochemical, ionic, magnetic, optical, and biosensing properties of solid state materials in bulk, thin film and particulate forms. Papers dealing with synthesis, processing, characterization, structure, physical properties and computational aspects of nano-crystalline, crystalline, amorphous and glassy forms of ceramics, semiconductors, layered insertion compounds, low-dimensional compounds and systems, fast-ion conductors, polymers and dielectrics are viewed as suitable for publication. Articles focused on nano-structured aspects of these advanced solid-state materials will also be considered suitable.