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DFT studies of refractive index of boron-doped diamond

Abstrakt

The density functional theory is one of the optimal solutions in calculation of optical properties of materials on the quantum scale. In this paper, we have investigated refractive index of a boron-doped diamond structure with the usage of Atomistic Toolkit software from Synopsys. During this study, various methods and pseudopotentials were checked to obtain an optimal performance-accuracy method for calculation of such materials. Leading method used in calculation was used meta-GGA with Fritz-Haber Institute pseudopotential. 

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Bartłomiej Dec. (2018). DFT studies of refractive index of boron-doped diamond, -. https://doi.org/10.4302/plp.v10i2.824

Informacje szczegółowe

Kategoria:
Doktoraty, rozprawy habilitacyjne, nostryfikacje
Typ:
Doktoraty, rozprawy habilitacyjne, nostryfikacje
Rok wydania:
2018

wyświetlono 3 razy

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