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High-pressure studies of MgTe using first-principle electronic-structure calculations
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UNSPECIFIED (1999) High-pressure studies of MgTe using first-principle electronic-structure calculations. PHYSICAL REVIEW B, 60 (17). pp. 11846-11847. ISSN 0163-1829.
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Abstract
We study the ground-state properties of MgTe and the behavior under pressure using the first-principles tight-binding linear muffin-tin orbital method within the local density approximation (LDA). The calculations clearly indicate that there is a structural transition from the B8 to B2, confirming recent experimental suggestions. We have further observed that there is an indirect band overlap metallization just before the structural transition. [S0163-1829(99)04838-9].
| Item Type: | Journal Article | ||||
|---|---|---|---|---|---|
| Subjects: | Q Science > QC Physics | ||||
| Journal or Publication Title: | PHYSICAL REVIEW B | ||||
| Publisher: | AMERICAN PHYSICAL SOC | ||||
| ISSN: | 0163-1829 | ||||
| Official Date: | 1 November 1999 | ||||
| Dates: |
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| Volume: | 60 | ||||
| Number: | 17 | ||||
| Number of Pages: | 2 | ||||
| Page Range: | pp. 11846-11847 | ||||
| Publication Status: | Published |
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