First-principles calculations to investigate the bulk, electronic, optical and thermoelectric properties of BaGe2As2 and BaGe2P2 alloys
The structural, elastic, electronic, and optical properties of BaGe2As2 and BaGe2P2 have been theoretically investigated, but their thermoelectric properties have not been reported. The current work aimed at conducting an exhaustive study on the bulk, electronic, and optical properties as well as th...
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Main Authors: | , , , |
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Format: | Article |
Language: | English |
Published: |
Elsevier
2024-12-01
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Series: | Results in Materials |
Subjects: | |
Online Access: | http://www.sciencedirect.com/science/article/pii/S2590048X24001092 |
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