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A first-principles computational comparison of defect-free and disordered, fluorinated anatase TiO(2) (001) interfaces with water

Chemical doping and other surface modifications have been used to engineer the bulk properties of materials, but their influence on the surface structure and consequently the surface chemistry are often unknown. Previous work has been successful in fluorinating anatase TiO(2) with charge balance ach...

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Detalles Bibliográficos
Autores principales: Reeves, Kyle G., Dambournet, Damien, Laberty-Robert, Christel, Vuilleumier, Rodolphe, Salanne, Mathieu
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9052303/
https://www.ncbi.nlm.nih.gov/pubmed/35496548
http://dx.doi.org/10.1039/c9ra10415a

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