Water/InP(001) from Density Functional Theory

[Image: see text] The interface between water and the In-rich InP(001) surface is studied by density functional theory with water coverage ranging from single molecules to multiple overlayers. Single molecules attach preferably to three-fold coordinated surface In atoms. Water dissociation is energe...

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Detalles Bibliográficos
Autores principales: Ruiz Alvarado, Isaac Azahel, Schmidt, Wolf Gero
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2022
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9202284/
https://www.ncbi.nlm.nih.gov/pubmed/35722024
http://dx.doi.org/10.1021/acsomega.2c00948

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9202284/
https://www.ncbi.nlm.nih.gov/pubmed/35722024
http://dx.doi.org/10.1021/acsomega.2c00948

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