期刊
JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS
卷 171, 期 -, 页码 -出版社
PERGAMON-ELSEVIER SCIENCE LTD
DOI: 10.1016/j.jpcs.2022.111025
关键词
Half-Heusler alloy; Spin dependent seebeck coefficient; Spin-polarization; Spin-caloritronics; Density functional theory
资金
- Government of Gujarat, India
- M.S. University of Baroda
- University Grant Commission, New Delhi
- [2020-21]
Recent progress in spin caloritronics has led to exploration of materials for their application in this field. In this study, doping of transition metals in a thermoelectric half-Heusler alloy induced spin polarization and spin-dependent transport properties. The results show significant changes in Seebeck coefficient, electrical conductivity, and electronic thermal conductivity, making Co-rich NbCoSb a promising candidate for spin caloritronics applications.
Recent progress in spin caloritronics has boosted exploration of materials for their application in this novel field. Heusler alloys which were being hailed as thermoelectric and magnetic materials have seen uprise for their suitable properties however lack of studies featuring good coupling between magnetic and thermoelectric properties have seen little impact in the field of spin-caloritronics. Present work explored doping of transition metal in a thermoelectric half-Heusler alloys NbCoSb on Nb site to induce spin-polarization and spin-dependent transport properties. Co (Mn) doping results in 98.09% (19.38%) negative spin polarization and 0.51 mu B/f.u. (1.98 mu B/f.u.) magnetic moment. Magnetic exchange parameter shows presence of long range RKKY-type interaction in Co and Mn doped NbCoSb. On one-hand, doping of Co and Mn in NbCoSb suppressed the elec-tronic transport properties whereas, on the other hand spin dependent Seebeck effect is introduced. The syn-ergistic effect of magnetic and thermoelectric properties in non-magnetic NbCoSb via doping of Mn and Co shows large variation in the value of Seebeck coefficient, electrical conductivity and electronic thermal conductivity with flipping of spin-directions suggests Co rich NbCoSb as a promising candidate for spin-caloritronics application.
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