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Phase transition of solid bismuth under high pressure
Affiliation:1.National Key Laboratory of Shock Wave and Detonation Physics, Institute of Fluid Physics, Mianyang 621900, China;2.Institute of High Energy Physics, Chinese Academy of Sciences, Beijing 100049, China
Abstract:As a widely used pressure calibrator, the structural phase transitions of bismuth from phase I, to phase II, to phase III,and then to phase V with increasing pressure at 300 K have been widely confirmed. However, there are different structural versions for phase III, most of which are determined by x-ray diffraction(XRD) technology. Using x-ray absorption fine structure(XAFS) measurements combined with ab initio calculations, we show that the proposed incommensurate composite structure of bismuth of the three configurations is the best option. An abnormal continuous increase of the nearest-neighbor distance of phase III with elevated pressure is also observed. The electronic structure transformation from semimetal to metal is responsible for the complex behavior of structure transformation.
Keywords:Bi  phase transition  pressure  XAFS  
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