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Origin of high thermoelectric performance of FeNb(1−x)Zr/Hf(x)Sb(1−y)Sn(y) alloys: A first-principles study
The previous experimental work showed that Hf- or Zr-doping has remarkably improved the thermoelectric performance of FeNbSb. Here, the first-principles method was used to explore the possible reason for such phenomenon. The substitution of X (Zr/Hf) atoms at Nb sites increases effective hole-pocket...
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| Publicado no: | Sci Rep |
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| Main Authors: | , , , , , , , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
Nature Publishing Group
2016
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC5015081/ https://ncbi.nlm.nih.gov/pubmed/27604826 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/srep33120 |
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