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Insulator-to-half metal transition and enhancement of structural distortions in [Formula: see text] double perovskite oxide via hole-doping
Using density functional theory calculations, we found that recently high-pressure synthesized double perovskite oxide [Formula: see text] exhibits ferrimagnetic (FiM) Mott-insulating state having an energy band gap of 0.20 eV which confirms the experimental observations (Feng et al. in Inorg Chem 5...
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| Publicado no: | Sci Rep |
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| Autor principal: | |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
Nature Publishing Group UK
2021
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC7806915/ https://ncbi.nlm.nih.gov/pubmed/33441783 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/s41598-020-80265-6 |
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