First-principle calculations of the fundamental properties of CuBrxI1−x ternary alloy
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- Type
- article
- Published
- 2015-05-28
- Cited by
- 2
- References
- 44
- OpenAlex
- https://openalex.org/W650746268
- Semantic Scholar
- https://api.semanticscholar.org/CorpusID:92973940
Keywords
Thermodynamics, Bulk modulus, Lattice constant, Ternary operation, Enthalpy of mixing
References
- The electronic band structures of InNxAs1−x, InNxSb1−x and InAsxSb1−x alloys
- Tuning the structural, electronic, and optical properties of BexZn1−xTe alloys
- Pressure dependence of the optical properties and the band structure of the copper and silver halides
- E0 band‐gap energy and lattice constant of ternary Zn1−xMgxSe as functions of composition
- Molecular dynamics simulation of CuI using a three-body potential
- Valence band structure of CuCl: an angle-resolved photoemission study
- Special quasirandom structures.
- Generalized Gradient Approximation Made Simple.
- The Elastic Behaviour of a Crystalline Aggregate
- Lattice Parameter and Density in Germanium-Silicon Alloys1
- Exact exchange-only potentials and the virial relation as microscopic criteria for generalized gradient approximations.
- Electronic structure of GaN with strain and phonon distortions.
- Electronic and optical properties of copper halide mixed crystals CuBr1-xIx
- First principles study of structural, elastic, electronic and optical properties of CuCl, CuBr and CuI compounds under hydrostatic pressure
- Inhomogeneous Electron Gas
- First-principles investigation of BNxP1−x, BNxAs1−x and BPxAs1−x ternary alloys
- Elastic and piezoelectric constants of the cuprous halides
- Accurate band gaps of semiconductors and insulators with a semilocal exchange-correlation potential.
- Biexciton lasing in CuCl quantum dots
- Ab initio calculation of electronic properties of alloys
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