The effect of strain on water dissociation on reduced rutile TiO(2)(110) surface

The effect of external uniaxial strain on water dissociation on a reduced rutile TiO(2)(110) surface has been theoretically studied using first-principles calculations. We find that when the tensile strain along [11̄0] is applied, the energy barrier of water dissociation substantially decreases with...

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Detalles Bibliográficos
Autores principales: Wang, Zhi-Wen, Chen, Wei-Guang, Teng, Da, Zhang, Jie, Li, An-Ming, Li, Zhao-Han, Tang, Ya-Nan
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2021
Materias:
Chemistry
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8695215/
https://www.ncbi.nlm.nih.gov/pubmed/35423380
http://dx.doi.org/10.1039/d1ra00251a

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8695215/
https://www.ncbi.nlm.nih.gov/pubmed/35423380
http://dx.doi.org/10.1039/d1ra00251a

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