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Pressure-Induced Metallization and Structural Transition of Orthorhombic Se

✍ Scribed by K. Nakano; Y. Akahama; H. Kawamura; M. Takumi; K. Nagata


Publisher
John Wiley and Sons
Year
2001
Tongue
English
Weight
83 KB
Volume
223
Category
Article
ISSN
0370-1972

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Using an ab initio pseudopotential approach and the local-density approximation for the exchange-correlation potential, we have predicted the structural phase transformation of BSb using two different ways: first, by calculating the equation of states of zincblende (ZB) and rocksalt (RS) structures