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Title of Journal: J Supercond Nov Magn

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Abbravation: Journal of Superconductivity and Novel Magnetism

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Springer US

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DOI

10.1007/s10928-012-9264-2

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ISSN

1557-1947

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FirstPrinciples Calculations of Electronic and Ma

Authors: W Adli A Zaoui M Ferhat
Publish Date: 2016/01/08
Volume: 29, Issue: 3, Pages: 839-845
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Abstract

In this paper we present theoretical investigations of electronic and magnetic properties of the ordered cubic ferromagnetic MnSe x S 1 −x MnSe x Te1 −x and MnSe x Po1 −x for x = 025 050 and 075 using the fullpotential linearized augmented plane wave method Regarding structural properties we found that the lattice parameters of MnSeS MnSeTe and MnSePo alloys follow Vegard’s law Results show that MnSe x Te1 −x exhibits a halfmetallic behaviour for all Mn concentrations while MnSeS is halfmetallic only for x = 05 and 075 and MnSePo is halfmetallic only for x = 025 Moreover a total magnetic moment of 5 µB is found for all alloys where the halfmetallic phase is present The total magnetic moment is found to be independent of composition and it is mainly due to the Mn atom

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Other Papers In This Journal:
  1. Range of the Kondo Cloud in Weakly Disordered Hosts
  2. Magnetic Resonance and Superconductivity: Some History, Ancient and in the Making
  3. Superconducting and Magnetic Properties of Zn-doped YBa 2 Cu 3 O 7− δ
  4. Bound Clusters and Pseudogap Transitions in Layered High-Tc Superconductors
  5. First-Principles Study on the (111) Surface of Half-Metallic CsN
  6. First-Principles Study on the (111) Surface of Half-Metallic CsN
  7. Novel Synthesis and Nanostructure Controlled Magnetic Characteristics of ε -Fe 3 N and γ ′-Ni x Fe 4− x N (0.2 ≤ x ≤ 0.8) Nitrides
  8. Stability Study of Mg and Al Doped and Co Doped ZnO Hydrides by Ab Initio Calculations
  9. Enhancement in the Superconductivity of Tl(Ba 2− x Mg x )(Ca 1 Be 1 )Cu 3 O 10− δ System with the Decreased Thickness of Charge Reservoir Layer
  10. Simulation of the Magnetic Induction Vector of a Magnetic Core to be Used in FFC NMR Relaxometry
  11. Effect of Fuel on the Synthesis, Structural, and Magnetic Properties of M-Type Hexagonal SrFe 12 O 19 Nanoparticles
  12. A Compact Treatment of Singular Impurities Using the Artificial Friedel Resonance (FAIR) Technique
  13. The Superconducting Magnetoresistance Effect in Ni 80 Fe 20 –Nb–Ni 80 Fe 20 and Co–Nb–Co Trilayers: Requisites for Tailoring its Magnitude
  14. Pressure-Induced Insulator to Metal Transition and Superconductivity of the Inert Gases
  15. Magnetic Properties of CuTi 2−2 x Cr 2 x S 4 Materials
  16. Phase Formation and Transition Temperature Variation of TlSr 2 (Ca 1− x R x )Cu 2 O 7 (R = Dy, Ho and Tb) Superconductor
  17. Phase Formation and Transition Temperature Variation of TlSr 2 (Ca 1− x R x )Cu 2 O 7 (R = Dy, Ho and Tb) Superconductor
  18. The Influence of Annealing Temperature on the Magnetic Properties of Mn 0.5 Co 0.5 Fe 2 O 4 Nanoferrites Synthesized via Mechanical Milling Method
  19. Microwave Surface Impedance and Complex Conductivity of High- T c Single Crystals: Current State and Unsolved Problems
  20. Crystal Structure and Magnetic Properties of (La 1− x Sr x MnO 3 ) N (LaCrO 3 ) 1− N Solid Solutions
  21. Local Structural Properties Around Cu Atoms in Checkerboard Phased Ca 2− x Na x CuO 2 Cl 2
  22. Enhancement of Phase Coherence Between Superconducting Grains in Strongly Underdoped Bi 2 Sr 2 CaCu 2 O 8+ δ
  23. Chaotic Dynamics of a Fractal Josephson Junction
  24. Magnetic Properties of the Ce(Pd 1− x Cu x ) 3 System
  25. Relationship between Spin Gap and Crystal Structure in La-214 Cuprate Superconductor
  26. Effect of La–Zn Substitution on the Structure and Magnetic Properties of Low Temperature Co-Fired M-Type Barium Ferrite
  27. Effect of Elaborating Technique on the Structural, Magnetic, and Magnetocaloric Properties of La 0 . 8 Ca 0 . 1 Na 0 . 1 Mno 3 Manganite
  28. Structural, Microstructural and Magnetic Characterizations of Mechanically Alloyed Fe 65 Si 20 Cr 15 Powders Mixture
  29. Observation of Small Exchange Bias in Defect Wüstite (Fe 0.93 O) Nanoparticles
  30. Magnetic Dilution Effects in the Intermetallic Compound GdIn 3
  31. On the Reflection of 3rd International Conference on Superconductivity and Magnetism—ICSM2012, Between 29th April–4th May, 2012, Istanbul, Turkey
  32. Lattice Effects in Diborides
  33. Lattice Anomalies and HTSC in Pnictides and Cuprates Studied by XAS: Polaron Resonance as a Common Clue
  34. Phase Separation in Electron Doped Iron-Selenide K 0.8 Fe 1.6 Se 2 Superconductor by Scanning X-ray Nano-Diffraction
  35. Intrinsic Spin Relaxation Processes in Metallic Magnetic Multilayers
  36. Physical and Mechanical Properties of GdBa 2 Cu 3 O 7− δ Added with Nanosized CoFe 2 O 4
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  38. Monte Carlo Study of the Phase Diagrams of a Ferrimagnetic Nanowire with Alternate Layers
  39. NMR Study Under Pressure on the La1111 Pnictides, LaFeAsO 1− x F x
  40. Antiferromagnetically Spin Polarized Oxygen and Manganese in MnO Layers Investigated by First Principle and Series Expansions Calculations
  41. Effects of Ni Substitution in Bi-2212 Superconductors
  42. A Study on the Insulation of the Termination for HTS Cable in Liquid Nitrogen
  43. Rapid Solid-State Synthesis of Oxides by Means of Irradiation with Light
  44. Processing and Properties of Bar-Shaped Single-Seeded and Multi-Seeded YBCO Bulk Superconductors by a Top-Seeded Melt Growth Technique
  45. Magnetism in Yttrium Intermetallics: Ab Initio Study
  46. Magneto-optical Magnetic Field Sensors Based on Compact Magnetophotonic Crystals
  47. Enhancement in High-Field J c Properties and the Flux Pinning Mechanism of MgB 2 Thin Films on Crystalline SiC Buffer Layers
  48. Properties of Dense Assemblies of Magnetic Nanoparticles Promising for Application in Biomedicine
  49. The Effect of Sn Substitution of Pb on Microstructure and Superconducting Properties of Bi–Pb–Sr–Ca–Cu–O Superconductor
  50. Synthesis of Superparamagnetic Ni 0.40 Zn 0.60 Fe 2 O 4 Nanoparticles Using a Microwave-Assisted Combustion Method
  51. Quantized Massive Gauge Fields and Hole-Induced Spin Glass Mechanism in Underdoped Cuprates
  52. Study of Electronic and Magnetic Properties of MnAu Nanowire
  53. Sintering Temperature Dependence of Evolving Morphologies and Magnetic Properties of Ni 0.5 Zn 0.5 Fe 2 O 4 Synthesized via Mechanical alloying
  54. First-Principles Study of Lattice Dynamics and Thermal Properties of Alkaline-Earth Metal Nitrides CaN, SrN, and BaN
  55. Physical Properties and Diffusion-Coefficient Calculation of Iron Diffused Bi-2223 System
  56. Improvement of the High-Magnetic-Field Critical Current Density of the Ex-Situ Annealed MgB 2 Thick Films by Oxygen Doping
  57. Structural, Thermal and Magnetic Properties of Nanocrystalline Co 80 Ni 20 Alloy Prepared by Mechanical Alloying
  58. Doping Dependence of Magnetic Field Penetration Depth in Kinetic Energy Driven Cuprate Superconductors
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  60. Monte Carlo Study of the Magnetic Properties in a Fullerene-Like Structure: X 20 , X 60 , or X 70
  61. From Local Moment EPR in Superconductors to Nanoscale Ferromagnets
  62. Relationship Between Annealing Time and Magnetic Properties in Bi-2212 Textured Composites
  63. On the Highlights of the 4 th International Conference on Superconductivity and Magnetism-ICSM2014, Antalya, Turkey
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