602 results on '"Bin Omran, S"'
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2. Structural electronic and optical properties of chalcopyrite compounds AuMTe2 (M = Ga, In) from first-principles calculation
3. An accurate DFT insights into optoelectronic, magnetic, thermodynamic and thermoelectric characteristics of monoclinic spiroffite Co2Te3O8
4. Electronic, elastic, and thermodynamic properties of Cd0.75TM0.25S (TM = Os or Ir) alloys with the TB-mBJ approach and hybrid density functional (HSE06)
5. Structural, Electronic, and Magnetic Characteristics of Co1-xFexMnSb: Insight from DFT Computation
6. Prediction of 2D XC2N4 (X= Ti, Mo, and W) monolayers with high mobility as an encouraging candidate for photovoltaic devices
7. K2Ag(Ga/In)Br6 lead-free HDPs: Investigation of the elastic, optoelectronic, optical coating, and thermal characteristics for thermoelectric and solar cells
8. An in-depth look at the stability, electronic structure, mechanical properties, and thermodynamics characteristic of Ir3TM (TM: Sc, Ti, V) compounds
9. Exploring optoelectronic, optical thin films, mechanical and thermal transport properties of bromide double perovskites Rb2Ag(Ga/In)Br6 for photovoltaic and thermoelectric applications
10. First-principles investigations of physical properties of CdXP2 (X = Si, Ge, and Sn) ternary chalcopyrite
11. Phase stability and physical behaviour of Fe3Pd, FePd and FePd3 binary intermetallic compounds
12. Theoretical investigations of Zr-concentration influence on the thermodynamic, elastic, electronic, and structural stability of D022/L12-Al3Ti
13. Structural, electronic, optical, elastic, mechanical, thermodynamic, and thermoelectric properties of lead-free and environmentally friendly CsSnX3 (X = Cl, Br) perovskites
14. Structural, electronic, optical, and thermoelectric studies on Zintl SrCd2Pn2 (Pn=P/As) compounds for solar cell applications: A First Principle Approach
15. Insight into physical properties of carbon-doped BeSiP2 and BeGeP2 chalcopyrite: An ab initio study
16. Theoretical insight on the electronic band structure, mechanical, vibrational and thermodynamic characteristic of antiperovskites RE3InN (RE=Y and La)
17. Ab initio predictions of the structural, electronic, optical, elastic, and thermoelectric properties of quasi-two-dimensional BaFZnP
18. Structural parameters, electronic structure and linear optical functions of LuXCo2Sb2 (X = V, Nb and Ta) double half Heusler alloys
19. Electronic and Magnetic Properties of Mn2YSn (Y = Ru, Rh, and Pd) Heusler Alloys Under Hydrostatic Pressure
20. Theoretical investigation of phonon modes related to first Brillouin zone centre and properties of double perovskites Ba2MWO6 (M=Mg, Zn, Cd)
21. Electronic band structure, mechanical and optical characteristics of new lead-free halide perovskites for solar cell applications based on DFT computation
22. First-principle investigations of structural, electronic, thermal, and mechanical properties of AlP1−xBix alloys
23. Corrigendum to “Phase stability and physical behaviour of Fe3Pd, FePd and FePd3 binary intermetallic compounds” [Phys. B Condens. Matter (2024) 416074]
24. Ab initio study of the pressure dependence of mechanical and thermodynamic properties of GeB2O4 (B = Mg, Zn and Cd) spinel crystals
25. Lattice-Dynamical, Elastic and Thermo-Dynamical Properties of GaAs, InAs, and their Mixed Ga1-xInxAs Alloys
26. A study of the structural, thermodynamic, magnetic, and optoelectronic properties of the Dy2Be2GeO7 complex oxide via ab initio methods
27. Elastic, electronic, optical and thermoelectric properties of the novel Zintl-phase Ba2ZnP2
28. A comprehensive study of mechanical, optoelectronic, and magnetic insights into terbium orthovanadate TbVO4 via first-principles DFT approach
29. Density functional theory investigation of the phase transition, elastic and thermal characteristics for AuMTe2(M = Ga,In) chalcopyrite compounds.
30. Insight into the Structural, Magneto-electronic, and Mechanical Characteristic of Y2MnZ (Z = Al, Ga, In) via DFT Computation
31. Effects of alloying chalcopyrite CuTlSe2 with Na on the electronic structure and thermoelectric coefficients: DFT investigation
32. Structural, elastic, mechanical, and thermodynamic characteristic of NaReO3 and KReO3 perovskite oxides from first principles study
33. Structural, magnetic, and optoelectronic properties of new ferromagnetic semiconductors Cd0.75Os0.25S and Cd0.75Ir0.25S: Insight from DFT computations
34. Ab initio exploration of the structural, elastic, electronic and optical properties of a new layered perovskite-type oxyfluoride: CsSrNb2O6F
35. Electronic band structure and optical characteristic of silver lanthanide XAgSe2 (X = Eu and Er) dichalcogenides: Insight from DFT computations
36. Metal to semiconductor transition and figure of merit enhancement of Li2CuAs compound by Na substitution
37. Density functional theory screening of some fundamental physical properties of Cs2InSbCl6 and Cs2InBiCl6 double perovskites
38. Correction to: Phosphide in gallium bismuth: structural, electronic, elastic, and optical properties of GaPxBi1−x alloys
39. Structural, optoelectronic and thermodynamic characteristic of orthorhombic SnZrCH3(CH=S, Se) compounds: Insights from DFT computations
40. First-principles predictions of the structural, electronic, optical and elastic properties of the zintl-phases AE3GaAs3 (AE = Sr, Ba)
41. Structural, electronic, optical and thermodynamic properties of the cubic quadratic quaternary alloys GaxIn1-xAsyN1-y. Insight from DFT computations
42. DFT-based computer simulation of the physical properties of transparent conducting oxide of delafossite-type: AgInO2 and AgYO2
43. Ab initio prediction of the structural, optoelectronic and thermoelectric properties of double half-Heusler (DHH) ScXRh2Bi2 (X = Nb, Ta) alloys DFT study results.
44. An accurate DFT insights into optoelectronic, magnetic, thermodynamic and thermoelectric characteristics of monoclinic spiroffite Co2Te3O8.
45. Structural electronic and optical properties of chalcopyrite compounds AuMTe2 (M = Ga, In) from first-principles calculation.
46. First-principles calculations of the structural, electronic, mechanical and thermodynamic properties of MAX phase Mon+1GeCn (n = 1–3) compounds
47. Ab initio prediction of the elastic, electronic and optical properties of a new family of diamond-like semiconductors, Li2HgMS4 (M = Si, Ge and Sn)
48. Theoretical investigation of the structural, elastic, electronic, and optical properties of the ternary tetragonal tellurides KBTe2 (B = Al, In)
49. Elastic, electronic, optical and thermodynamic properties of Ba3Ca2Si2N6 semiconductor: First-principles predictions
50. Temperature and doping effects on the transport properties of SrIn2P2 Zintl compound
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