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Alkaline earth atom doping-induced changes in the electronic and magnetic properties of graphene: a density functional theory study
Density functional theory was used to investigate the effects of doping alkaline earth metal atoms (beryllium, magnesium, calcium and strontium) on graphene. Electron transfer from the dopant atom to the graphene substrate was observed and was further probed by a combined electron localization funct...
| Autores principales: | , , , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
The Royal Society of Chemistry
2021
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8694801/ https://www.ncbi.nlm.nih.gov/pubmed/35423162 http://dx.doi.org/10.1039/d0ra08115a |