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Adsorption of Sc on the Surface of Kaolinite (001): A Density Functional Theory Study
The adsorption behavior of Sc on the surface of kaolinite (001) was investigated using the density functional theory via the generalized gradient approximation plane-wave pseudopotential method. The highest coordination numbers of hydrated [Formula: see text] , [Formula: see text] , and [Formula: se...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2023
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10419994/ https://www.ncbi.nlm.nih.gov/pubmed/37570051 http://dx.doi.org/10.3390/ma16155349 |