Origin of ferromagnetism and its pressure and doping dependence in Tl2Mn2O7.
Using the Nth order muffin-tin obital downfolding technique, we investigate the origin of ferromagnetism in pyrochlore Tl2Mn2O7. It is found to be driven by a hybridization induced spin polarization of delocalized charge carriers derived from Tl-s and O-p states. The mean-field estimate of the ferromagnetic transition temperature Tc estimated using computed exchange integrals are found to be in good agreement with measurements. We find an enhancement of Tc for moderate doping with nonmagnetic Sb and a suppression of Tc upon application of pressure, both in agreement with experimental findings.
Saha-Dasgupta
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S.N. Bose National Centre for Basic Sciences, Kolkata 700098, India.
De Raychaudhury
Molly
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Sarma
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