first-principles investigation of density of states and electron density in wurtzitein0.5ga0.5nalloys with gga-pbesol method

Authors

ali hashemizadeh

department of physics, payame noor university, tehran, iran vahid mohammadi siavashi

department of physics, payame noor university, tehran, iran

abstract

in present work, we have calculated the electronic properties including density of states (dos) and electron density for gan, inn and in wurtzite phase for x=0.5. the study is based on density functional theory (dft) with full potential linearized augmented plane wave method (fp-lapw) by generalized gradient approximation (gga-pbesol) for calculating electronic properties. in this report we concluded that inxga1-xn band gap, which would be decreased with increasing in concentration and gan is very sensitive on in content. in present work, we have calculated the electronic properties including density of states (dos) and electron density for gan, inn and in wurtzite phase for x=0.5. the study is based on density functional theory (dft) with full potential linearized augmented plane wave method (fp-lapw) by generalized gradient approximation (gga-pbesol) for calculating electronic properties. in this report we concluded that inxga1-xn band gap, which would be decreased with increasing in concentration and gan is very sensitive on in content.

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Journal title:
journal of nanostructures

جلد ۶، شماره ۴، صفحات ۲۷۳-۲۷۷

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