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Ab initio structural dynamics of pure and nitrogen-containing amorphous carbon
Amorphous carbon (a-C) has attracted considerable interest due to its desirable properties, which are strongly dependent on its structure, density and impurities. Using ab initio molecular dynamics simulations we show that the sp(2)/sp(3) content and underlying structural order of a-C produced via l...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Nature Publishing Group UK
2023
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10640601/ https://www.ncbi.nlm.nih.gov/pubmed/37951996 http://dx.doi.org/10.1038/s41598-023-46642-7 |