ELECTRONIC BAND STRUCTURE AND FERMI SURFACE OF YTTERBIUM UNDER HIGH PRESSURE.

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作者
Sankar, Sambasivam [1 ]
Iyakutti, Kombiahthevar [1 ]
Dakshinamoorthy, Mamundi [1 ]
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[1] Univ of Madras, Madras, India, Univ of Madras, Madras, India
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BAND STRUCTURE;
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摘要
The energy band structure of fcc ytterbium has been calculated by the relativistic augmented plane wave method for a wide range of pressures by reduction of the unit cell volume between 1. 0 V//0 to 0. 5 V//0 where V//0 is the volume of the unit cell at normal pressure. The metal is observed to undergo a metal semiconductor transition for a compression of V/V//0 equals 0. 8 and a semiconductor to metal transition at V/V//0 equals 0. 6. The possibility of a valence change from 2** plus to 3** plus has been predicted for the volume range V equals 0. 6 V//0 to 0. 5 V//0. The changes in the Fermi surface topology, density of states, and resistivity have been investigated for the first time to provide confirmatory evidence for the above results.
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页码:359 / 370
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