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Abstracts
We present first-principles calculations of the structural and lattice-dynamical properties for cubic yttrium nitride. The ground state properties, such as the lattice constant and the bulk modulus, are calculated using a plane wave pseudopotential method within density functional theory. A linear-response approach to density functional theory is used to derive the phonon frequencies. In this work, we present plane-wave pseudopotential calculations within density functional theory and calculate the phonon frequencies for high symmetry points.
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Pages
317-319
Physical description
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published
2013-02
Contributors
author
- Dokuz Eylül University, Faculty of Sciences, Physics Department, 35160 Izmir, Turkey
author
- Dokuz Eylül University, Faculty of Sciences, Physics Department, 35160 Izmir, Turkey
author
- Adnan Menderes University, Faculty of Sciences and Arts, Physics Department, 09100 Aydin, Turkey
References
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Publication order reference
Identifiers
YADDA identifier
bwmeta1.element.bwnjournal-article-appv123n2054kz