First-principles calculations of the thermodynamic and structural properties of strained and alloys
- 15 July 2000
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review B
- Vol. 62 (4) , 2475-2485
- https://doi.org/10.1103/physrevb.62.2475
Abstract
We present first-principles calculations of the thermodynamic and structural properties of cubic and alloys. They are based on the generalized quasichemical approach to disorder and composition effects and a pseudopotential-plane-wave approximation for the total energy. The cluster treatment is generalized to study the influence of biaxial strain. We find a remarkable suppression of phase separation in
Keywords
This publication has 52 references indexed in Scilit:
- Theory of AlN, GaN, InN and their alloysPublished by Elsevier ,1998
- Atomic Scale Indium Distribution in a GaN/In0.43Ga0.57N/Al0.1Ga0.9N Quantum Well StructureJapanese Journal of Applied Physics, 1997
- Calculation of unstable mixing region in wurtzite In1−x−yGaxAlyNApplied Physics Letters, 1997
- Solubility of nitrogen in binary III–V systemsJournal of Crystal Growth, 1997
- Phase separation in InGaN thick films and formation of InGaN/GaN double heterostructures in the entire alloy compositionApplied Physics Letters, 1997
- The Blue Laser DiodePublished by Springer Nature ,1997
- Solid phase immiscibility in GaInNApplied Physics Letters, 1996
- Internal strain energy of ternary solid solutions of cubic modificationSemiconductor Science and Technology, 1996
- Microwave performance of a 0.25 μm gate AlGaN/GaN heterostructure field effect transistorApplied Physics Letters, 1994
- Electronic structure and equilibrium properties ofN alloysPhysical Review B, 1993