An ab initio pseudopotential plane wave method using linear response approach has been employed to study the lattice dynamics of two cubic antiperovskites AsNBa 3 and SbNBa 3 . The bulk properties, elastic constants, phonon dispersion curves, phonon density of states and temperature dependent thermo
โฆ LIBER โฆ
First-principle studies of the lattice dynamics of crystals, and related properties
โ Scribed by Gonze, Xavier; Rignanese, Gian-Marco; Caracas, Razvan
- Book ID
- 115452448
- Publisher
- Oldenbourg Wissenschaftsverlag
- Year
- 2005
- Tongue
- English
- Weight
- 404 KB
- Volume
- 220
- Category
- Article
- ISSN
- 2194-4946
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