Cargando...

Adsorption of iron tetraphenylporphyrin on (111) surfaces of coinage metals: a density functional theory study

The adsorption of the iron tetraphenylporphyrin (FeTPP) molecule in its deckchair conformation was investigated on Au(111), Ag(111) and Cu(111) surfaces by performing spin-polarized density functional theory (DFT) calculations taking into account both van der Waals (vdW) interaction and on-site Coul...

Descripción completa

Guardado en:
Detalles Bibliográficos
Publicado en:Beilstein J Nanotechnol
Autores principales: Tang, Hao, Tarrat, Nathalie, Langlais, Véronique, Wang, Yongfeng
Formato: Artigo
Lenguaje:Inglês
Publicado: Beilstein-Institut 2017
Materias:
Acceso en línea:https://ncbi.nlm.nih.gov/pmc/articles/PMC5704758/
https://ncbi.nlm.nih.gov/pubmed/29234584
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3762/bjnano.8.248
Etiquetas: Agregar Etiqueta
Sin Etiquetas, Sea el primero en etiquetar este registro!