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DEFECT CHEMISTRY OF P TYPE MIXED IONIC AND ELECTRONIC CONDUCTORS

机译:P型混合离子和电子导体的缺陷化学

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摘要

Two universal defect chemistry models are presented to relate the properties of a variety of p type perovskite conductors, including chromites, manganites, and ferrites, which can be tailored as mixed ionic and electronic conductors (MIECs). It is found that oxygen nonstoichiometry in these p type MIECs can be correlated using a term we call the ability for oxygen vacancy generation (AOG). The values of AOG can be obtained by simulating the electronic conductivity as a function of oxygen activity and temperature with two existing universal models that are based on the concept of delocalized electron holes and localized electron holes, respectively. Both the global defect chemistry models yield a significant difference of ability for oxygen vacancy generation for all the oxides in this study, which allows us to better understand and predict the electrochemical properties of perovskite type p-type conductors.
机译:提出了两个通用缺陷化学模型,以涉及各种P型钙钛矿导体的性质,包括铬铁矿,锰铁和铁氧体,其可以定制为混合离子和电子导体(MIEC)。发现这些P型MIEC中的氧非计量法可以使用术语来相关,我们称之为氧空位生成(aog)。可以通过将电子电导率模拟作为氧活性和温度的函数来获得AOG的值,其具有基于被截面的电子孔和局部电子孔的概念的两个现有的通用模型。全局缺陷化学模型均产生本研究所有氧化物的氧空位生成能力差异,这使我们能够更好地理解并预测钙钛矿型P型导体的电化学性质。

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