112 results on '"Bin Omran, S"'
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2. Structural, electronic, optical, and thermoelectric studies on Zintl SrCd2Pn2 (Pn=P/As) compounds for solar cell applications: A First Principle Approach
3. Structural, optoelectronic, thermodynamic and thermoelectric properties of double half Heusler (DHH) Ti2FeNiSb2 and Ti2Ni2InSb compounds: A TB-mBJ study
4. Theoretical insight on the electronic band structure, mechanical, vibrational and thermodynamic characteristic of antiperovskites RE3InN (RE=Y and La)
5. Ab initio predictions of the structural, electronic, optical, elastic, and thermoelectric properties of quasi-two-dimensional BaFZnP
6. Insight into physical properties of carbon-doped BeSiP2 and BeGeP2 chalcopyrite: An ab initio study
7. Theoretical investigation of phonon modes related to first Brillouin zone centre and properties of double perovskites Ba2MWO6 (M=Mg, Zn, Cd)
8. Structural parameters, electronic structure and linear optical functions of LuXCo2Sb2 (X = V, Nb and Ta) double half Heusler alloys
9. Ab initio study of the pressure dependence of mechanical and thermodynamic properties of GeB2O4 (B = Mg, Zn and Cd) spinel crystals
10. Structural properties, electronic band structure, magnetic and mechanical characteristic of XFeGe (X = Co, Cr, Ni) half Heusler compounds: Insights from DFT calculation
11. Elastic, electronic, optical and thermoelectric properties of the novel Zintl-phase Ba2ZnP2
12. A comprehensive study of mechanical, optoelectronic, and magnetic insights into terbium orthovanadate TbVO4 via first-principles DFT approach
13. First-principles study of half-metallic properties in X2CrAl (X = Co and Mn) FullHeusler and their quaternary MnCoCrAl and CoMnCrAl compounds
14. Ab initio exploration of the structural, elastic, electronic and optical properties of a new layered perovskite-type oxyfluoride: CsSrNb2O6F
15. Electronic band structure and optical characteristic of silver lanthanide XAgSe2 (X = Eu and Er) dichalcogenides: Insight from DFT computations
16. Structural, optoelectronic and thermodynamic characteristic of orthorhombic SnZrCH3(CH=S, Se) compounds: Insights from DFT computations
17. Theoretical study of thermal conductivity, mechanical, vibrational and thermodynamical properties of Ln2Zr2O7 (Ln = La, Nd, Sm, and Eu) pyrochlore
18. First-principles predictions of the structural, electronic, optical and elastic properties of the zintl-phases AE3GaAs3 (AE = Sr, Ba)
19. Structural, electronic, optical and thermodynamic properties of the cubic quadratic quaternary alloys GaxIn1-xAsyN1-y. Insight from DFT computations
20. Electronic band structure, phase stability, magnetic and thermoelectric characteristics of the quaternary Heusler alloys CoCuZrAs and CoRhMoAl: Insights from DFT computations
21. DFT-based computer simulation of the physical properties of transparent conducting oxide of delafossite-type: AgInO2 and AgYO2
22. First-principles calculations of the structural, electronic, mechanical and thermodynamic properties of MAX phase Mon+1GeCn (n = 1–3) compounds
23. Ab initio prediction of the elastic, electronic and optical properties of a new family of diamond-like semiconductors, Li2HgMS4 (M = Si, Ge and Sn)
24. Theoretical investigation of the structural, elastic, electronic, and optical properties of the ternary tetragonal tellurides KBTe2 (B = Al, In)
25. Elastic, electronic, optical and thermodynamic properties of Ba3Ca2Si2N6 semiconductor: First-principles predictions
26. Temperature and doping effects on the transport properties of SrIn2P2 Zintl compound
27. Electronic structure and optical properties of the dialkali metal monotelluride compounds: Ab initio study
28. Electronic, optical, elastic, thermoelectric and thermodynamic properties of the spinel oxides ZnRh2O4 and CdRh2O4
29. Insight into the structural, elastic and electronic properties of tetragonal inter-alkali metal chalcogenides CsNaX (X=S, Se, and Te) from first-principles calculations
30. Electronic and thermoelectric properties of the layered BaFAg Ch ( Ch = S, Se and Te): First-principles study
31. Theoretical investigation of the structural, elastic, electronic and optical properties of the ternary indium sulfide layered structures A InS 2 ( A = K, Rb and Cs)
32. The influence of mechanical and electrical boundary conditions on electrocaloric response in (Ba0.50Sr0.50)TiO3 thin films
33. Phase transition and high-pressure thermodynamic properties of CdN derived from first-principles and quasi-harmonic Debye model
34. Computational investigations on band structure and electronic features of chromium-based carbides and nitride Cr3PX (X = C and N) through the FP-APW+LO approach
35. Structural, elastic, electronic and optical properties of the novel quaternary diamond-like semiconductors Cu2MgSiS4 and Cu2MgGeS4
36. Thickness dependence of electrocaloric response in ferroelectric thin films
37. Influence of strain on an epitaxial ferroelectric (Ba 0.50 Sr 0.50 )TiO 3 nanodot under different electrical boundary conditions
38. Structural, elastic, mechanical and thermodynamic properties of Terbium oxide: First-principles investigations
39. Phase-transition character in (Ba0.50,Sr0.50)TiO3 nanodots from first principles
40. Structural, half-metallic magnetism and elastic properties of the KMnQ2 (Q=O, S, Se, Te) chalcogenides from first-principles calculations
41. Structural, electronic and magnetic properties of Fe2-based full Heusler alloys: A first principle study
42. Combined theoretical studies of the optical characteristics of II-IV-V 2 semiconductor thin films
43. Electronic, optical and thermoelectric properties of XNMg3 (X=P, As, Sb, Bi) compounds
44. An ab initio study of the structural, elastic, electronic, optical properties and phonons of the double perovskite oxides Sr 2 AlXO 6 ( X =Ta, Nb, V)
45. Structural, electronic, bonding and thermo-elastic properties of orthorhombic and cubic CeO 2 compound
46. GGA+U study on phase transition, optoelectronic and magnetic properties of AmO2 with spin–orbit coupling
47. Structural, elastic, electronic and optical properties of the quaternary nitridogallate LiCaGaN2: First-principles study
48. A new type photodiode: p-Si/GaN pn junction in series with GaN/Ag Schottky diode
49. Structural, mechanical, electronic and magnetic properties of a new series of quaternary Heusler alloys CoFeMnZ (Z=Si, As, Sb): A first-principle study
50. Study of structural, electronic and magnetic properties of CoFeIn and Co2FeIn Heusler alloys
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