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Energy band gap and optical properties of lithium niobate from ab initio calculations

Computational materials science, 2013-11, Vol.79, p.125-131

2013

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Ab initio study of electronic structures and magnetism in ZnMnTe and CdMnTe diluted magnetic semiconductors

Journal of magnetism and magnetic materials, 2006-07, Vol.302 (2), p.536-542

2006

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X-ray absorption near-edge structure and valence state of Mn in (Ga,Mn)N

Physical review. B, Condensed matter and materials physics, 2005-09, Vol.72 (11), Article 115209

2005

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First principle investigation of electronic and optical properties of graphene/h-BN bilayers using Tran-Blaha-modified Becke-Johnson potential

Optical and quantum electronics, 2023-04, Vol.55 (4), Article 367

2023

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Electron–phonon coupling contribution on the optical absorption and the dynamic of exciton-polaron in monolayer Transition Metal Dichalcogenides

Optical and quantum electronics, 2021-11, Vol.53 (11), Article 654

2021

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Decoherence of Magneto-Bipolaron with Strong Coupling in a Quantum Dot Qubit Under Applied Electric Field

Journal of low temperature physics, 2021-10, Vol.205 (1-2), p.11-28

2021

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Properties of strained zinc-blende GaN: first-principles study

Journal of alloys and compounds, 2004-03, Vol.366, p.86-93

2004

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Structural stability, elastic and electronic properties of zincblende (GaN)1/(ZnO)1 superlattice: Modified Becke–Johnson exchange potential

Materials science in semiconductor processing, 2014-03, Vol.19, p.179-185

2014

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First-principles investigation of electronic structure and magnetic properties in ferromagnetic Ga1−xMnxN and Al1−xMnxN

Journal of physics. D, Applied physics, 2005-06, Vol.38 (12), p.1853-1859

2005

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First principle study of structural stability, electronic structure and optical properties of Ga doped ZnO with different concentrations

Materials research express, 2017-03, Vol.4 (3), p.35901

2017

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Molecular-dynamics simulations of structural and thermodynamic properties of ZnTe using a three-body potential

Solid state sciences, 2003-09, Vol.5 (9), p.1211-1216

2003

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Ab initio study of electronic properties of zincblende AlN and deformation potentials under hydrostatic stress

Materials chemistry and physics, 2003-11, Vol.82 (2), p.471-477

2003

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Full-potential investigation of the electronic and optical properties of stressed CdTe and ZnTe

Materials chemistry and physics, 2005-08, Vol.92 (2), p.333-339

2005

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Zinc-blende AlN and GaN under pressure: structural, electronic, elastic and piezoelectric properties

Semiconductor science and technology, 2004-11, Vol.19 (11), p.1220-1231

2004

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Prediction study of elastic properties under pressure effect for zincblende BN, AlN, GaN and InN

Solid-state electronics, 2004-09, Vol.48 (9), p.1601-1606

2004

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Effect of Chromium and Vanadium on Nanolayered Ternary Carbides: AB Initio Study

Materials science forum, 2009-01, Vol.609, p.239-242

2009

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Ab initio study of structural parameters and gap bowing in zinc-blende AlxGa1−xN and AlxIn1−xN alloys

Journal of applied physics, 2005-09, Vol.98 (6)

2005

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Numerical simulation of highly photovoltaic efficiency of InGaN based solar cells with ZnO as window layer

Journal of Ovonic Research, 2023-07, Vol.19 (4), p.421-431

2023

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Ab Initio Calculation of Electronic Structure and Magnetic Properties of Rare Earth Nitride Using LDA+U Approach: EuN and GaEuN

Materials science forum, 2009, Vol.609, p.167-172

2009

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DFT investigation of structural, electronic and optical properties of pure and Er-doped ZnO: Modified Becke-Johnson exchange potential

Optik (Stuttgart), 2017-01, Vol.128, p.274-280

2017

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An insight into electronic and optical properties of the chalcopyrite CuGaSe2 compound under low pressure, calculations from mBJ potential and topological analysis of electron density

Optik (Stuttgart), 2018-12, Vol.174, p.27-34

2018

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Engineering the optical and electronic properties of (AlN)1/(ZnO)1 superlattice by bi-axial stresses

Optik (Stuttgart), 2020-01, Vol.200, p.163437, Article 163437

2020

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Stress-dependence tight binding study of tellurium-based II–VI semiconductors

Physics letters. A, 2003-08, Vol.315 (1), p.143-149

2003

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(BN)1/(InN)1, (AlN)1/(InN)1 and (GaN)1/(InN)1 (001) superlattices: An opto-electronic and bonding properties

Optik (Stuttgart), 2018-09, Vol.168, p.287-295

2018

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Simulation and Modeling of Structural Stability, Electronic Structure and Optical Properties of ZnO

Energy procedia, 2015, Vol.74, p.1517-1524

2015

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Energy band gap and optical properties of lithium niobate from ab initio calculations

Ab initio study of electronic structures and magnetism in ZnMnTe and CdMnTe diluted magnetic semiconductors

X-ray absorption near-edge structure and valence state of Mn in (Ga,Mn)N

First principle investigation of electronic and optical properties of graphene/h-BN bilayers using Tran-Blaha-modified Becke-Johnson potential

Electron–phonon coupling contribution on the optical absorption and the dynamic of exciton-polaron in monolayer Transition Metal Dichalcogenides

Decoherence of Magneto-Bipolaron with Strong Coupling in a Quantum Dot Qubit Under Applied Electric Field

Properties of strained zinc-blende GaN: first-principles study

Structural stability, elastic and electronic properties of zincblende (GaN)1/(ZnO)1 superlattice: Modified Becke–Johnson exchange potential

First-principles investigation of electronic structure and magnetic properties in ferromagnetic Ga1−xMnxN and Al1−xMnxN

First principle study of structural stability, electronic structure and optical properties of Ga doped ZnO with different concentrations

Molecular-dynamics simulations of structural and thermodynamic properties of ZnTe using a three-body potential

Ab initio study of electronic properties of zincblende AlN and deformation potentials under hydrostatic stress

Full-potential investigation of the electronic and optical properties of stressed CdTe and ZnTe

Zinc-blende AlN and GaN under pressure: structural, electronic, elastic and piezoelectric properties

Prediction study of elastic properties under pressure effect for zincblende BN, AlN, GaN and InN

Effect of Chromium and Vanadium on Nanolayered Ternary Carbides: AB Initio Study

Ab initio study of structural parameters and gap bowing in zinc-blende AlxGa1−xN and AlxIn1−xN alloys

Numerical simulation of highly photovoltaic efficiency of InGaN based solar cells with ZnO as window layer

Ab Initio Calculation of Electronic Structure and Magnetic Properties of Rare Earth Nitride Using LDA+U Approach: EuN and GaEuN

DFT investigation of structural, electronic and optical properties of pure and Er-doped ZnO: Modified Becke-Johnson exchange potential

An insight into electronic and optical properties of the chalcopyrite CuGaSe2 compound under low pressure, calculations from mBJ potential and topological analysis of electron density

Engineering the optical and electronic properties of (AlN)1/(ZnO)1 superlattice by bi-axial stresses

Stress-dependence tight binding study of tellurium-based II–VI semiconductors

(BN)1/(InN)1, (AlN)1/(InN)1 and (GaN)1/(InN)1 (001) superlattices: An opto-electronic and bonding properties

Simulation and Modeling of Structural Stability, Electronic Structure and Optical Properties of ZnO

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