Cargando…

Molecular Adsorption of H(2) on Small Neutral Silver–Copper Bimetallic Nanoparticles: A Search for Novel Hydrogen Storage Materials

[Image: see text] In the search for novel hydrogen storage materials, neutral silver–copper bimetallic nanoparticles up to the size of eight atoms (Cu(m)Ag(n): m + n ≤ 8) have been computationally studied. Density functional theory with the B3LYP exchange–correlation functional and the combined basi...

Descripción completa

Detalles Bibliográficos
Autores principales: Perera, Sathya M., Hettiarachchi, Samanthika R., Hewage, Jinasena W.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2022
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8772317/
https://www.ncbi.nlm.nih.gov/pubmed/35071919
http://dx.doi.org/10.1021/acsomega.1c06146