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Exploration of the structural, vibrational, electronic, mechanical and thermal properties of Ru(4)Al(3)B(2) and Ru(9)Al(3)B(8): a DFT study
The structural, dynamical, electro-optical, mechanical, and thermal characteristics of the newly synthesized intermetallic compounds Ru(4)Al(3)B(2) and Ru(9)Al(3)B(8) have been studied under ambient and elevated pressure through density functional theory (DFT). The obtained lattice parameters of the...
| Autores principales: | , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
The Royal Society of Chemistry
2023
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10544048/ https://www.ncbi.nlm.nih.gov/pubmed/37790092 http://dx.doi.org/10.1039/d3ra05334b |