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Effects of the Hubbard U correction on the electronic and magnetic properties of the tetragonal V(2)P(2) sheet
A recent theoretical work predicted the orthorhombic phase of the V(2)P(2) sheet with the half-metallic electronic property using a linear combination of atomic orbitals (LCAO) basis set based on density functional theory (DFT). However, in the plane-wave DFT method, the tetragonal (t) V(2)P(2) phas...
| 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/PMC9043019/ https://www.ncbi.nlm.nih.gov/pubmed/35493135 http://dx.doi.org/10.1039/d1ra07558f |