Structural, electronic, magnetic, and optical investigations of sodium chalcogenides: First-principles calculations
The electronic, magnetic, and optical properties of NaS and NaSe compounds have been studied by using first-principles calculations based on density-functional theory and full-potential linearized augmented plane-wave method. The Perdew–Burke–Ernzerhof generalized gradient approximation (PBE-GGA) an...
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| Principais autores: | , , , , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
AIP Publishing LLC
2023-01-01
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| coleção: | AIP Advances |
| Acesso em linha: | http://dx.doi.org/10.1063/5.0129392 |
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