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Structure and Electronic Properties of Transition Metal Doped Kaolinite Nanoclay
In this work, a series of transition metal (Cr, Mn, Fe, and Co) doped kaolinite nanoclays were investigated by density functional theory (DFT) calculations. The influence of metal doping on geometric structure and electronic structure of kaolinite was analyzed. The ferromagnetic (FM), antiferromagne...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Springer US
2017
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5471148/ https://www.ncbi.nlm.nih.gov/pubmed/28618720 http://dx.doi.org/10.1186/s11671-017-2188-4 |