Search Results - "Benghia, Ali"
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Theoretical investigation of structural, electronic and thermoelectric properties of p-n type Mg2Si1-xSnx system
Published in Pramāṇa (2020)“…Based on the density functional theory and the Boltzmann transport theory, the thermoelectric properties of Mg 2 Si 1 - x Sn x solid solution with x = 0.25 ,…”
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Exploring the electrical properties of pressboard and kraft paper insulation in power transformers: A dielectric spectroscopy and principal component analysis approach
Published in AIMS environmental science (01-01-2024)“…We explored the aging effects on insulating materials used in power transformers through dielectric spectroscopy. Frequency domain spectroscopy (FDS) was…”
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Synthesis and Characterization of Novel Nanoparticles of Lithium Aluminum Iodate LiAl(IO 3 ) 4 , and DFT Calculations of the Crystal Structure and Physical Properties
Published in Nanomaterials (Basel, Switzerland) (03-12-2021)“…Here we report on the non-hydrothermal aqueous synthesis and characterization of nanocrystalline lithium aluminum iodate, LiAl(IO ) . Morphological and…”
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Simple New Method for the Preparation of La(IO 3 ) 3 Nanoparticles
Published in Nanomaterials (Basel, Switzerland) (30-11-2020)“…We present a cost- and time-efficient method for the controlled preparation of single phase La(IO ) nanoparticles via a simple soft-chemical route, which takes…”
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First-principles investigation on the stability and material properties of all-inorganic cesium lead iodide perovskites CsPbI3 polymorphs
Published in Physica. B, Condensed matter (15-05-2020)“…Cesium metal halide perovskites are very promising light absorbing materials for solar cells, due to their good thermal stability compared to other…”
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Effect of p-toluenesulfonyl hydrazide on copper corrosion in hydrochloric acid solution
Published in Corrosion science (01-04-2020)“…[Display omitted] •p-toluenesulfonylhydrazide has been studied as a new effective inhibitor for Cu.•A high inhibition performance is attributed to forming a…”
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Optimized opto-electronic and mechanical properties of orthorhombic methylamunium lead halides (MAPbX3) (X = I, Br and Cl) for photovoltaic applications
Published in Solar energy (01-04-2019)“…•The intrinsic properties of MAPbX3 (X = I, Br and Cl) are described.•The optimized orthorhombic structures based on the ab-initio DFT calculation.•The…”
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First principle calculation of physical properties of barium based chalcogenides BaM4S7 (M=Ga, Al); a DFT, DFT-D and hybrid functional HSE06 study
Published in Optical materials (01-04-2016)“…The electronic structure, elastic and optical properties have been calculated for the novel nonlinear optical (NLO) crystals BaQ4S7 (Q = Ga, Al) using plane…”
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Electronic, elastic, linear and nonlinear optical properties of beryllium based chalcopyrite BeMN2 (M = C, Si): An ab-initio study
Published in Physica. B, Condensed matter (15-05-2019)“…The BeCN2 and BeSiN2 compounds with the non-centrosymmetric chalcopyrite structure have been investigated by means of ab-initio density functional theory…”
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Experimental synthesis of double perovskite functional nano-ceramic Eu2NiMnO6: Combining optical characterization and DFT calculations
Published in Journal of solid state chemistry (01-07-2023)“…We reported on the synthesis of the pure double perovskite Eu2NiMnO6 in nano ceramic forms by two different methods solvotermal and sol-gel routes without…”
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Ab intio investigation of electronic and magnetic properties of Ca1-x TMx Te (TM = V, Cr, and Mn)
Published in Journal of magnetism and magnetic materials (15-11-2021)“…•Halfmetallicity of doping V, Cr and Mn in CaTe is assessed using TB-MBJ potential.•Zener’s double exchange mechanism can explain the ferromagnetism of…”
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Predictive machine learning approaches for perovskites properties using their chemical formula: towards the discovery of stable solar cells materials
Published in Neural computing & applications (01-09-2024)“…In recent years, notable progress in computational density functional theory (DFT) has facilitated the collection of extensive datasets in the field of…”
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Dihydrogen molecule adsorption with the platinum alloys based on transition metal PtX {111} (X = Mo, W) surface for catalysis purpose: Density functional theory
Published in Chemical physics letters (01-12-2020)“…[Display omitted] •The ability of PtX{111} (X = Mo, W) alloys to catalyze the dissociative adsorption reaction of H2.•Four different sites were investigated:…”
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Effect of metal (Ag and Cd) substitution on methylammonium lead iodideperovskiteMAPbI3optoelectronic properties for photovoltaic applications
Published in Organic electronics (01-12-2019)“…Organometallic perovskite (OMHP) based solar cells, with higher than 24% of power conversion efficiency (PCE), attract special attention. High absorption…”
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Insights on the opto-electronic structure of the inorganic mixed halide perovskites γ-CsPb(I1-xBrx)3 with low symmetry black phase
Published in Journal of alloys and compounds (15-08-2020)“…Inorganic halide perovskites especially CsPbI3 have attracted great attention in optoelectronics and photovoltaic fields due to their good thermal stability…”
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Simulation of electronic and optical properties of polyene-diphenylaniline-sensitizers for perovskite n-ZnTiO3 towards efficient dye sensitized solar cells
Published in Materials science in semiconductor processing (01-11-2021)“…Four polyene-diphenylaniline dyes (D5, D7, D9 and D11) are simulated here, for the first time, as sensitizers for nano-ZnTiO3-based dye-sensitized solar cells…”
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Effect of iodic acid concentration in preparation of zinc iodate: Experimental characterization of Zn(IO3)2, and its physical properties from density functional theory
Published in Vacuum (01-11-2020)“…We synthesized pure Zn(IO3)2 structures employing a chemical method and characterized them using the electron microscopy to understand the effect of acidity on…”
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Investigation of triphenylamine-based sensitizer characteristics and adsorption behavior onto ZnTiO3 perovskite (1 0 1) surfaces for dye-sensitized solar cells using first-principle calculation
Published in Chemical physics (01-02-2020)“…[Display omitted] •We describe four different triphenylamine-based dyes, named as TPA-1, TPA-2, TPA-3 and TPA-4, with different linkages.•We investigate the…”
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Machine Learning Models for Efficient Property Prediction of ABX 3 Materials: A High-Throughput Approach
Published in ACS omega (18-11-2024)Get full text
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