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High-pressure electrides: From design to synthesis

High-pressure electrides: From design to synthesis
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摘要 Electrides are unique ionic compounds that electrons serve as the anions. Many electrides with fascinating physical and chemical properties have been discovered at ambient condition. Under pressure, electrides are also revealed to be ubiquitous crystal morphology, enriching the geometrical topologies and electronic properties of electrides. In this Review,we overview the formation mechanism of high-pressure electrides(HPEs) and outline a scheme for exploring new HPEs from pre-design, CALYPSO assisted structural searches, indicators for electrides, to experimental synthesis. Moreover, the evolution of electronic dimensionality under compression is also discussed to better understand the dimensional distribution of anionic electrons in HPEs. Electrides are unique ionic compounds that electrons serve as the anions. Many electrides with fascinating physical and chemical properties have been discovered at ambient condition. Under pressure, electrides are also revealed to be ubiquitous crystal morphology, enriching the geometrical topologies and electronic properties of electrides. In this Review,we overview the formation mechanism of high-pressure electrides(HPEs) and outline a scheme for exploring new HPEs from pre-design, CALYPSO assisted structural searches, indicators for electrides, to experimental synthesis. Moreover, the evolution of electronic dimensionality under compression is also discussed to better understand the dimensional distribution of anionic electrons in HPEs.
作者 Biao Wan Jingwu Zhang Lailei Wu Huiyang Gou 万彪;张静武;吴来磊;缑慧阳(Key Laboratory of Metastable Materials Science and Technology,College of Material Science and Engineering,Yanshan University,Qinhuangdao 066004,China;Center for High Pressure Science and Technology Advanced Research,Beijing 100094,China)
出处 《Chinese Physics B》 SCIE EI CAS CSCD 2019年第10期50-55,共6页 中国物理B(英文版)
关键词 ELECTRIDES HIGH PRESSURE CALYPSO STRUCTURAL SEARCH electrides high pressure CALYPSO structural search
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