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- W2890766621 abstract "AbstractThe density functional method with pseudopotentials are used to study the electron states of nanoparticles and nanostructured systems: chains, films, and three-dimensional nanosystems of titanium and zirconia. It is shown that all studied titanium nanosystems have the density of electronic states (DES) of the metallic type, but zirconia nanosystem demonstrates a dielectric energy gap in the vicinity of the Fermi level. The density of states of nanostructured titanium is close in shape to DES of the single crystal but has a smoother shape due to disordering of the atomic arrangement. The forbidden band width of the nanostructured zirconia is smaller as compared to the corresponding width in crystalline ZrO_2, supposedly because of incomplete saturation of ionic bonds." @default.
- W2890766621 created "2018-09-27" @default.
- W2890766621 creator A5018023981 @default.
- W2890766621 date "2018-01-01" @default.
- W2890766621 modified "2023-10-05" @default.
- W2890766621 title "Электронные состояния наноструктурированных систем: титан и диоксид циркония" @default.
- W2890766621 doi "https://doi.org/10.21883/ftt.2018.10.46509.076" @default.
- W2890766621 hasPublicationYear "2018" @default.
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