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Borates as a new direction in the design of oxide ion conductors
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作者 Xiaohui Li Li Yang +10 位作者 Zhenyu Zhu Xiaoge Wang Pohua Chen Senchuan Huang Xianyi Wei Guohong Cai pascal manuel Sihai Yang Jianhua Lin Xiaojun Kuang Junliang Sun 《Science China Materials》 SCIE EI CAS CSCD 2022年第10期2737-2745,共9页
Lowering the operating temperature of solid oxide fuel cells(SOFCs)has extensively stimulated the development of new oxide ion conductors.Here,inspired by the structural commonalities of oxide ion conductors,the inabi... Lowering the operating temperature of solid oxide fuel cells(SOFCs)has extensively stimulated the development of new oxide ion conductors.Here,inspired by the structural commonalities of oxide ion conductors,the inability to accommodate oxygen vacancies in the rigid,isolated,3-fold tetrahedral rings of SrSi/GeO_(3)-based materials,and the considerable flexibility of BO_(n) polyhedra in terms of coordination number,rotation,deformation,and linkage,we report the first borate-base family of oxide ion conductors,(Gd/Y)_(1−x)Zn_(x)BO_(3−0.5x),through combined computational prediction and experimental verification.The oxygen vacancies in(Gd/Y)BO_(3)can be accommodated by forming B_(3)O_(8)units in isolated,3-fold,tetrahedral rings of B_(3)O_(9)and transported through a cooperative mechanism of oxygen exchange between the B_(3)O_(9)and B_(3)O_(8)units,which is assisted by the intermediate opening and extending of these units.This study opens a new scientific field of the borate system for designing and discovering oxide ion conductors. 展开更多
关键词 solid oxide fuel cells (Gd/Y)1−xZnxBO3−0.5x oxide ion migration mechanism borate oxide ion conductors ab initio molecular dynamics simulations
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Erratum to:Borates as a new direction in the design of oxide ion conductors(vol 65,issue 10,page 2737,2022)
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作者 Xiaohui Li Li Yang +10 位作者 Zhenyu Zhu Xiaoge Wang Bohua Chen Senchuan Huang Xianyi Wei Guohong Cai pascal manuel Sihai Yang Jianhua Lin Xiaojun Kuang Junliang Sun 《Science China Materials》 SCIE EI CAS CSCD 2022年第11期3186-3186,共1页
In the version of the article originally published in the volume 62,issue 10,2022 of Sci.china Mater.(page 2737-2745,https://doi.org/10.1007/s40843-022-2044-3).The chemical shift reported in Figure 5f for the^(11)B so... In the version of the article originally published in the volume 62,issue 10,2022 of Sci.china Mater.(page 2737-2745,https://doi.org/10.1007/s40843-022-2044-3).The chemical shift reported in Figure 5f for the^(11)B solid-state NMR spectra is incorrect because no parameter correction was performed during data processing. 展开更多
关键词 FIGURE CORRECTION processing.
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