scholarly journals Anomalous transport properties of the half-metallic ferromagnets Co 2 TiSi, Co 2 TiGe and Co 2 TiSn

Author(s):  
Joachim Barth ◽  
Gerhard H. Fecher ◽  
Benjamin Balke ◽  
Tanja Graf ◽  
Andrey Shkabko ◽  
...  

In this work, the theoretical and experimental investigations of Co 2 Ti Z ( Z =Si, Ge or Sn) compounds are reported. Half-metallic ferromagnetism is predicted for all three compounds with only two bands crossing the Fermi energy in the majority channel. The magnetic moments fulfil the Slater–Pauling rule and the Curie temperatures are well above room temperature. All compounds show a metallic-like resistivity for low temperatures up to their Curie temperature, above the resistivity changes to semiconducting-like behaviour. A large negative magnetoresistance (MR) of 55 per cent is observed for Co 2 TiSn at room temperature in an applied magnetic field of μ 0 H =4 T , which is comparable to the large negative MRs of the manganites. The Seebeck coefficients are negative for all three compounds and reach their maximum values at their respective Curie temperatures and stay almost constant up to 950 K. The highest value achieved is −52 μVK −1 for Co 2 TiSn, which is large for a metal. The combination of half-metallicity and the constant large Seebeck coefficient over a wide temperature range makes these compounds interesting materials for thermoelectric applications and further spincaloric investigations.

2022 ◽  
Vol 896 ◽  
pp. 163130
Author(s):  
Qasim Mahmood ◽  
Ghazanfar Nazir ◽  
Sonia Bouzgarrou ◽  
M.S. Rashid ◽  
Eman Algrafy ◽  
...  

2010 ◽  
Vol 97 (12) ◽  
pp. 122503 ◽  
Author(s):  
E. J. Kan ◽  
H. J. Xiang ◽  
F. Wu ◽  
C. Tian ◽  
C. Lee ◽  
...  

2010 ◽  
Author(s):  
Van An Dinh ◽  
Kazunori Sato ◽  
Hiroshi Katayama-Yoshida ◽  
Marília Caldas ◽  
Nelson Studart

2021 ◽  
Vol 7 ◽  
Author(s):  
Junquan Deng ◽  
Wuqing Yang ◽  
Aiyuan Hu ◽  
Peng Yu ◽  
Yuting Cui ◽  
...  

New diluted magnetic semiconductors represented by Li(Zn,Mn)As with decoupled charge and spin doping have received much attention due to their potential applications for spintronics. However, their low Curie temperature seriously restricts the wide application of these spintronic devices. In this work, the electronic structures, ferromagnetic properties, formation energy, and Curie temperature of Cu doped LiMgN and the corresponding Li deficient system are calculated by using the first principles method based on density functional theory, combined with Heisenberg model in the Mean-Field Approximation. We find that the Cu doped systems have high temperature ferromagnetism, and the highest Curie temperature is up to 573K, much higher than the room temperature. Li(Mg0.875Cu0.125)N is a half metallic ferromagnet and its net magnetic moments are 2.0 μв. When Li is deficient, the half metallic ferromagnetism becomes stronger, the magnetic moments increase to 3.0 μв. The bonding and differential charge density indicate that the half metallic ferromagnetism can be mainly attributed to the strong hybridization between N 2p and doped Cu 3d orbitals. The results show that Cu doped LiMgN is a kind of ideal new dilute magnetic semiconductor that will benefit potential spintronics applications.


2011 ◽  
Vol 25 (18) ◽  
pp. 1537-1548 ◽  
Author(s):  
M. YOGESWARI ◽  
G. KALAPANA

Self-consistent ab initio calculations were carried out to study the structural, electronic and magnetic properties of nine ternary compounds Ca 4 XA 3 ( X = B , C and N ; A = S , Se and Te ). The calculations were performed by using tight-binding linear muffin tin orbital (TB-LMTO) method within the local density approximation (LDA). The calculations reveal that half-metallic ferromagnetism can be obtained for C - and N -doping with the integer magnetic moment of 2.00 μ B and 1.00 μ B per cell. However, B substitution does not induce magnetism in CaS and CaSe systems, but it produces ferromagnetism in CaTe system with magnetic moment of 2.67 μ B per cell. Moreover C - and N -doping enhance the stable ferromagnetic state in calcium chalcogenide systems. Spin-dependent electronic band structure, total and partial densities of state calculations demonstrate that localized magnetic moments substantially come from impurity atoms. Half-metallic ferromagnetism predominately originates from spin-polarization of electrons in 2p orbital states of C and N atoms. In addition, equilibrium lattice constant, bulk modulus, atomic local magnetic moments, half-metallic gap and robustness of half-metallicity have been calculated.


2004 ◽  
Vol 19 (9) ◽  
pp. 2738-2741 ◽  
Author(s):  
Ming Zhang ◽  
Ekkes Brück ◽  
Frank R. de Boer ◽  
Guodong Liu ◽  
Haining Hu ◽  
...  

The hypothetical wurtzite structure chromium chalcogenides were investigated through first-principle calculation within density-functional theory. All compounds are predicted to be true half-metallic ferromagnets with an integer Bohr magneton of 4 μB per unit. Their half-metallic gaps are 1.147, 0.885, and 0.247 eV at their equilibrium volumes for wurtzite-type CrM (M = S, Se, and Te), respectively. The half-metallicity can be maintained even when volumes are expanded by more than 20% for all compounds and compressed by more than 20%, 20%, and 5%, for CrS, CrSe, and CrTe, respectively.


RSC Advances ◽  
2018 ◽  
Vol 8 (45) ◽  
pp. 25653-25663 ◽  
Author(s):  
Jabbar M. Khalaf Al-zyadi ◽  
Ammar A. Kadhim ◽  
Kai-Lun Yao

Recent studies have indicated that the quaternary Heusler alloy CoRuMnSi shows a half-metallic ferromagnetism (Kundu et al., Sci. Rep., 7, (2017), 1803).


2012 ◽  
Vol 90 (6) ◽  
pp. 531-536 ◽  
Author(s):  
M. Moradi ◽  
M. Rostami ◽  
M. Afshari

The magnetic properties of MS (M = Li, Na, K) compounds in a Wurtzite structure at zero pressure are investigated by using first principle calculations and the pseudopotential self-consistent method based on density functional theory. It is shown that MS compounds in Wurtzite structure are half-metallic ferromagnets with a magnetic moment of μB per formula unit and half-metallic gaps of 0.24, 0.52, and 0.62 eV for LiS, NaS, and KS, respectively. We also consider the effect of pressure on the half-metallicity of these compounds and we find that LiS, NaS, and KS in Wurtzite structure maintain their half-metallicity up to lattice compressions of 9%, 37%, and 60%, respectively, and as a result one can grow them over the semiconductors in Wurtzite structures that are produced experimentally. These properties cause Wurtzite MS compounds to be appropriate choices to create useful devices in spintronics.


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