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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...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2022
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| 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 |