Investigation of Room Temperature Ferromagnetism, Mechanical and Thermoelectric Aspects of Na2MoZ6 (Z = Cl, Br, I) for Spintronic Applications
Bibliographic record
Abstract
No abstract is available for this record. The assistant can identify its topic from the title, but cannot infer the study’s results.
Source: Not provided · Quality: missing
Research context
OpenAlex topics: Heusler alloys: electronic and magnetic properties · Thermal Expansion and Ionic Conductivity · Magnetic and transport properties of perovskites and related materials
SciVX discovery tags are terminology-based. OpenAlex topics are source-provided classifications.
References (70)
Show source-provided references
1. Zener model description of ferromagnetism in zinc-blende magnetic semiconductors10.1126/science.287.5455.1019 ↗
2. Structural, electronic, optical, and elastic properties of Ba2XSbO6 (X=Dy, La) double perovskites: a first-principles study for spintronic and optoelectronic applications10.1007/s12648-025-03730-w ↗
3. A. Ullah, S. Belhachi, W. M. Almalki, A. H. Alfaifi, et al., First-principles study of Sr2CeBiO6 and Ba2CeBiO6 double perovskites for optoelectronic applications, Indian Journal of Physics, https://doi.org/10.1007/s12648-025-03768-w.10.1007/s12648-025-03768-w ↗
4. DFT analysis of rare-earth double perovskite oxides KXSn2O6 (X = Pr, Nd)10.1016/j.ssc.2025.116110 ↗
5. Enhancing electronic and magnetic properties in Eu-doped GaN nanowires via p-p-hybridization of Eu-defect complexes10.1002/adts.202400277 ↗
6. Strain-engineering of electronic and magnetic properties of chemically passivated zigzag GaN, nanoribbons: an ab initio study10.1021/acsaenm.2c00266 ↗
7. Exploration of Ti0.9Fe0.1-xNixO2 thin films as dilute magnetic semiconductors10.1016/j.tsf.2021.138941 ↗
8. Pulsed laser deposited cobalt doped Ti0.9Fe0.1-xO2 thin films: structural, morphological, magnetic, optical, and electrical properties10.1016/j.ceramint.2020.11.223 ↗
9. DFT analysis of Sr₂GdMO₆ (M =bi, Sb) double perovskites for Spintronics and UV optoelectronics10.1007/s10948-025-07011-9 ↗
10. DFT analysis of Ba2XTaO6 (X = Sm, Er) perovskites: stability & functional properties10.1016/j.jpcs.2025.112974 ↗
11. First-principles investigation of structural, electronic, optical, and mechanical properties of novel metallic ternary halides K3XBr6 (X = Sc, Y)10.1016/j.rinp.2025.108347 ↗
12. IS Roqan, the magnetic ordering in high magnetoresistance Mn-doped ZnO thin films AIP
13. Analysis on the energetics, magnetism, and electronic properties in a ZnO grain boundary doped with Gd RSC
14. The origin of room temperature ferromagnetism mediated by co–V Zn complexes in the ZnO grain boundary10.1039/C6RA11607H ↗
15. Curie temperature behavior in half-metallic ferromagnetic double perovskites within the electronic correlation picture10.1103/PhysRevB.97.195155 ↗
16. The discovery, development and future of GMR: the Nobel prize10.1088/0022-3727/41/9/093001 ↗
17. Enhanced magnetoresistance in layered magnetic structures with antiferromagnetic interlayer exchange10.1103/PhysRevB.39.4828 ↗
18. Layered magnetic structures: interlayer exchange coupling and giant magnetoresistance10.1016/0304-8853(94)00880-9 ↗
19. Origin and control of ferromagnetism in dilute magnetic semiconductors and oxides10.1063/1.2832613 ↗
20. Anomalous exchange interactions in III-V dilute magnetic semiconductors
21. Role of embedded clustering in dilute magnetic semiconductors: Cr doped GaN10.1103/PhysRevLett.95.256404 ↗
22. Magnetism in re-based ferrimagnetic double perovskites10.1088/1367-2630/11/7/073047 ↗
23. Growth and properties of high-curie-temperature Sr2CrReO6 thin films10.1063/1.1769085 ↗
24. X-ray magnetic circular dichroism study of re 5d magnetism in Sr2CrReO610.1063/1.2131178 ↗
25. A neutron scattering study of the crystal and magnetic structure of Sr2CrOsO610.1016/j.jmmm.2006.10.648 ↗
26. H. Kato, T. Okuda, Y. Okimoto, Y, Tomioka, Y. Takenoya, A. Ohkubo, M. Kawasaki, and Y. Tokura, Metallic ordered double-perovskite Sr2CrReO6 with maximal curie temperature of 635 K, Appl. Phys. Lett., 81 (2002) 328.10.1063/1.1493646 ↗
27. Giant negative magnetoresistance in perovskite-like La 2/3 Ba1/3MnO x ferromagnetic films10.1103/PhysRevLett.71.2331 ↗
28. Growth and properties of high-curie-temperature Sr2CrReO6 thin films10.1063/1.1769085 ↗
29. X-ray magnetic circular dichroism study of re 5d magnetism in Sr2Cr ReO610.1063/1.2131178 ↗
30. A neutron scattering study of the crystal and magnetic structure of Sr2CrOsO610.1016/j.jmmm.2006.10.648 ↗
31. Role of 5d orbital of Re in ferromagnetism and thermoelectric characteristics of Cs2ReCl/Br6 double-perovskites: a density functional theory study10.1140/epjp/s13360-020-00743-8 ↗
32. Ab initio study for the structural, electronic, magnetic, optical, and thermoelectric properties of K2OsX6 (X= cl, Br) compounds10.1002/er.5613 ↗
33. The significance of anti-fluorite Cs2NbI6 via its structural, electronic, magnetic, optical, and thermoelectric properties10.1002/er.5638 ↗
34. The role of 5d electrons spin in quantum ferromagnetism and transport properties of double perovskites Cs2ZCl/Br6 (Z= Ta, W) for spintronic applications10.1140/epjp/s13360-021-01286-2 ↗
35. A new lead-free double perovskites K2Ti(cl/Br)6; a promising material for optoelectronic and transport properties; probed by DFT10.1016/j.matchemphys.2021.124435 ↗
36. First-principles study of lead-free double perovskites K2Pt(cl/Br)6 for optoelectronic and renewable energy applications10.1016/j.jssc.2021.122294 ↗
37. Study of half-metallic ferromagnetism and transport properties of Cs2XI6 (X = transition metals) for spintronic and energy harvesting applications10.1016/j.jpcs.2024.112363 ↗
38. Exploring the ferromagnetic semiconducting and transport properties of Na2ReX6 (X = cl and Br) for spintronic and thermoelectric applications10.1016/j.cplett.2024.141748 ↗
39. Tunability of half metallicity and thermoelectric indicators in Na2TaX6 (X = cl, Br) vacancy ordered double perovskites
40. Investigations of mechanical, magnetic, and thermoelectric properties of double perovskites Na2IrX6 (X=cl, Br) for spintronic and energy harvesting applications10.1016/j.matchemphys.2025.130501 ↗
41. Alawaideh, first-principles study of A-site cation effects in halide double perovskites A2NaMoI6 (a = Cs, Rb) for photovoltaic applications10.1007/s10971-025-06713-9 ↗
42. Investigating the physical characteristics of halide double perovskites X2LiSbI6 (X=K, Cs): a first-principles approach10.1007/s10904-024-03560-z ↗
43. Unlocking stability and efficiency in double inorganic halide perovskite Cs2KMoX6 (X=cl, I) materials through first principles study10.1007/s10904-024-03529-y ↗
44. Blaha · 2001
45. Generalized Gradient Approximation Made Simple [Phys.Rev. Lett. 77, 3865 (1996)]10.1103/PhysRevLett.78.1396 ↗
46. Accurate band gaps of semiconductors and insulators with a semilocal exchange-correlation potential10.1103/PhysRevLett.102.226401 ↗
47. A code for calculating band-structure dependent quantities10.1016/j.cpc.2006.03.007 ↗
48. First principles phonon calculations in materials science10.1016/j.scriptamat.2015.07.021 ↗
49. Ligand-hole in [SnI6] unit and origin of band gap in photovoltaic perovskite variant Cs2SnI610.1246/bcsj.20150110 ↗
50. Layer-dependent electronic and magnetic properties for Cr2NO2 and Cr2CO210.1016/j.jmmm.2022.169952 ↗
51. Structural, electronic, optical, and magnetic properties of NbFePb2O6 ferromagnetic semiconductor double perovskite compound10.1016/j.cplett.2025.142022 ↗
52. First principles investigations of electronics, magnetic, and thermoelectric properties of rare earth-based PrYO3 (Y=Cr, V) perovskites10.1016/j.cap.2017.07.010 ↗
53. Theoretical prediction of curie temperature in two-dimensional ferromagnetic monolayer10.1063/5.0092142 ↗
54. Study of curie temperature, ferromagnetism and thermoelectric properties of spinels CdCr2X4 (X=S, se, Te) for spintronic and energy harvesting10.1016/j.mseb.2024.117747 ↗
55. Spin-lattice coupling and phonon dispersion of CdCr2O4 from first principles10.1103/PhysRevB.86.184429 ↗
56. Exploring magnetism of lead-free halide double perovskites: a high-throughput first-principles study
57. Engineering magnetism in hybrid organic–inorganic metal halide perovskites10.1039/D4MH01762E ↗
58. First principles study of ferromagnetism, optical and thermoelectric behaviors of AVO3 (a= ca, Sr, Ba) perovskites10.1016/j.matchemphys.2018.03.019 ↗
59. Theoretical study on the magnetic moment’s formation in ta-doped anatase TiO2
60. DFT-based insight into the magnetic and thermoelectric characteristics of XTaO3 (X= Rb, Fr) ternary perovskite oxides for optoelectronic applications10.1002/er.5968 ↗
61. Vibrational and transport phenomenon in Cs2CdZnCl6 double perovskite: a DFT study10.1016/j.ssi.2023.116401 ↗
62. Investigation of thermoelectric properties of ZnV2O4 compound at high temperatures10.1088/0022-3727/49/42/425601 ↗
63. Enhanced thermoelectric properties of BiCoO3 by nickel substitution
64. First-principles calculations to investigate structural, electronic, optical, and thermodynamic properties of anti-perovskite compounds X3OI(X = Na, K, Rb)10.1016/j.jmrt.2022.12.148 ↗
65. Necessary and sufficient elastic stability conditions in various crystal systems10.1103/PhysRevB.90.224104 ↗
66. Shift of indirect to direct bandgap and thermoelectric response of the cubic BiScO3 via DFT-mBJ studies10.1016/j.mssp.2016.03.014 ↗
67. A simplified method for calculating the Debye temperature from elastic constants10.1016/0022-3697(63)90067-2 ↗
68. Effect of intrinsic point-defect complex on elastic properties of γ’-Ni3Al phases10.1088/2053-1591/ac07e7 ↗
69. Electronic and bonding analysis of hardness in pyrite-type transition-metal pernitrides10.1103/PhysRevB.90.134102 ↗
70. Xia · A Unified Understanding of Minimum Lattice Thermal Conductivity · 2023 · 120