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Structural and Electronic Properties of Iron-Doped Sodium Montmorillonite Clays: A First-Principles DFT Study
[Image: see text] First-principles calculations done via density functional theory were used to study the structural and electronic properties of sodium montmorillonite clay (Mt-Na(+)) of general formula M(x)Al(3)Si(8)O(24)H(4)Na·nH(2)O (M(x): Mg or Fe). The final position of the interlamellar sodiu...
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| 發表在: | ACS Omega |
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| Main Authors: | , , , |
| 格式: | Artigo |
| 語言: | Inglês |
| 出版: |
American Chemical Society
2019
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| 在線閱讀: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6740045/ https://ncbi.nlm.nih.gov/pubmed/31528789 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acsomega.9b00685 |
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