2,618 results on '"Murtaza, G."'
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2. Bandgap Nature Transition and the Optical Properties of ABX3 (A = K, Rb; B = Sr, Ba, Ca; X = Cl, Br, I) Perovskites under Pressure
3. Investigation of Promising Lead-Free Double Perovskites Rb2TlBiZ6 (Z=Cl, Br, and I) as Sustainable Alternatives for Photovoltaic and Wasted Heat Conversion Applications: First Principles Analysis
4. Uniaxial Strain Engineering of Electronic, Elastic and Optical Properties of Halide Double Perovskites K2NaTIX6 (X = I, Br, and Cl): A DFT Insight
5. DFT Insight on Future Prospects of Double Perovskites A2YCuZ6 (A = Rb, Cs and Z = Cl, Br) for Energy Conversion Technologies
6. First principles investigations of chalcogenides perovskites for optoelectronic applications
7. Synthesis, characterization, and evaluation of improved electrochemical performance of vanadium and zinc co-doped Ni-rich oxide cathode materials: experimental and first-principles study
8. Impact of Halide Ion Occupancy on Thermodynamic, Mechanical, Electro-optic, and Electron Transport Characteristics of Rb2CuAsX6 (X = F, Cl, Br) Double Perovskites Using Density Functional Theory
9. Crystal Stability, Chemical Bonding, Optical and Thermoelectric Properties of LaAgZnX2 (X = P, As) Through First Principles Study
10. Evaluation of Physical Properties of A2ScCuCl6 (A = K, Rb, and Cs) Double Perovskites via DFT Framework
11. Ab Initio Study of Lead-Free Double Halide Perovskite X2GeSnCl6 (X = Na, K) Compounds for Energy Conversion System
12. Investigation of structure, morphology, dielectric, and optoelectronic properties of La-doped BaZrO3: experimental and DFT analysis
13. Study of structural and magnetic properties of Sn-doped cobaltite perovskite LaCoO3: experimental and DFT approach
14. Probing structural, mechanical, electronic, optical, and transport properties of K2InSbX6 (X = Cl, Br) for optoelectronic and thermoelectric applications: DFT investigation
15. Doping-induced band gap tuning in Cs2AgBiBrxCl6−x double perovskites for high frequency optoelectronic applications
16. Exploring the stability, optoelectronic, and thermoelectric properties of Sc-based double perovskites X₂ScAgI₆ (X = K, Rb, Cs) for renewable energy applications
17. First-principles calculations to investigate Electronic, half-metallicity, thermodynamics, thermoelectric and mechanical properties of new Half-Heusler alloys FeCoZ (Z = Si, Ge, and Pb)
18. The effect of PBEsol GGA and mBJ potentials on the structural, electronic, optical, elastic and thermoelectric properties of A2BAuI6 (A = K or Rb or Cs, B = Sc or Y)
19. Exploring energy harvesting potential of lithium-based halide perovskites Li2CuSbZ6 (Z=Cl, Br): First principles approach
20. Structural stability, optoelectronic, thermoelectric, and elastic characteristics of X2ScBiO6 (X= Mg, Ca, and Ba) double perovskites for energy harvesting: First-principles analysis
21. Study of Pr doped nanocrystalline LiCoO2 cathode material for spintronic and energy storage applications: A theoretical and experimental analysis
22. First-principles exploration of redox, electronic, thermoelectric, and thermodynamic properties of binary transition metal NaX1/3Mn2/3O2 (X = Ag, W, Zr) for enhanced performance of Na-ion batteries
23. Understanding the properties of novel ternary LiXN2 (X = V, Nb) nitrides for energy harvesting applications: A first-principles study
24. Computational study of the structural, optoelectronic, magnetic, and thermoelectric properties of novel EuMg2C2 (C=P and As) zintl compounds
25. First-principles calculations to investigate magnetic, electronic, and thermoelectric response of europium-based half metallic ternary Zintl compounds EuMg2X2 (X=Sb and Bi)
26. Investigation of Pressure-Dependent Electronic and Optical Properties of Double Perovskites Cs2AgXY6 (X = Bi, In; Y = Cl, Br)
27. Computational determination of structural, electronic, magnetic and elastic properties of CsXB (X = Mg and Sr) do half-Heusler alloys as potential spintronic materials
28. Synthesis, characterization, and photocatalytic performance of gold ions implanted TiO2/graphene nanocomposites for efficient dye photodegradation
29. Exploring Rb2YCuCl6 and Cs2YCuCl6 double perovskites: Structural, electronic, optical, elastic, and thermoelectric properties via density functional theory
30. Computational investigation of the structural, mechanical and acoustic characteristics of rare earth based Heusler compounds
31. Study of the optical response and thermal heat conversion efficiency of quaternary Zintl (RECuZnAs2, where RE = Y, Lu) compounds through first principles study
32. Ab initio analysis of structural, electronic, magnetic, thermodynamic, and elastic properties of Half Heusler alloys ZMnAs (Z = Be, Mg) for spintronics applications
33. Synthesis, Structural, Morphological, and Optical Properties of Promising Lead-Free Double Perovskite Na2CuBiBr6: A Sustainable Material for Photovoltaic Applications
34. Computational insight on K2AuBiX6 (X = F, Cl, Br, I) double perovskites to comprehensively investigate mechanical, optoelectronic, and thermoelectric features for green energy applications
35. On the evaluation of accretion process near a quantum-improved charged black hole
36. First-principles calculations to investigate Electronic, Optical, Mechanical, and transport characteristics of novel A2BAuCl6 (A = K/Rb/Cs; B = Sc/Y)
37. DFT study of structural, electronic, magnetic, elastic, and thermoelectric properties of Ta-based half-Heusler alloys CsTaX (X = C, Si, and Ge) for spintronics and thermoelectric technologies
38. First-principles predictions of structure, half-metallic antiferromagnetism, optoelectronic, and elastic properties of double perovskites A2TaNiO6 (A = Ca, Sr, and Ba) for energy harvesting
39. Physical properties and defect processes of Zr3AC2 (A=Al and Si) MAX phases: Implication for radiation tolerance
40. Optical and transport properties of novel X2BAgCl6 (where X = K, Rb, Cs, and B = Sc, Y) double perovskites
41. Revealing vibrational, elastic, electro-optic, and thermoelectric aspects of double perovskites Na2ScCuX6 (X=Cl, Br) for energy harvesting applications by implementing DFT approach
42. Ab initio analysis of structural, optoelectronic, thermoelectric, and elastic characteristics of K2MBiBr6 (M = Na, Ag, and Cu) for green energy
43. The investigation of structural, electronic, thermal, and elastic properties of X2ZnH4 (X = K, Rb and Cs) for hydrogen storage applications: DFT study
44. Lead-Free Double Perovskites Rb2TlSbX6 (X=Cl, Br, and I) As an Emerging Aspirant for Solar Cells and Green Energy Applications
45. A DFT investigation on halide double perovskites X2ScTlI6 (X= Rb, Cs) for thermoelectric and optoelectronic applications
46. Comprehensive study of structural, elastic, electronic, optical, and thermoelectric properties of Rb2NaTlZ6 (Z = Cl, Br, and I) by DFT
47. Structural, elastic, optoelectronic, and transport properties of Na-based halide double perovskites Na2CuMX6 (M = Sb, Bi, and X = Cl, Br) as renewable energy materials: A DFT insight
48. Pressure influenced electronic phase transition, mechanical, optoelectronic, and transport characteristics of double perovskite Rb2AgSbCl6: A first-principles investigation
49. Effect of finite temperatures on the dispersion properties of Surface Magnetoplasmon Polaritons in the Voigt reflection geometry
50. First-principles study of structural, electronic, mechanical, optical, thermodynamic and thermoelectric properties of ternary ZnSnN2 and ZnMoN2 nitrides
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