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1.
Sci Rep ; 5: 8620, 2015 Mar 02.
Artigo em Inglês | MEDLINE | ID: mdl-25727134

RESUMO

The itinerant electron metamagnetism (IEM) is an essential physical concept, describing magnetic properties of rare earth - transition metal (R-TM) intermetallics, demonstrating technologically important giant magnetoresistance and magnetocaloric effects. It considers an appearance of TM magnetization induced by spontaneous magnetization of surrounding R atoms, which provides significant response of the magnetic and transport properties on variation of external parameters (temperature, pressure, magnetic field) due to strong coupling between magnetic sublattices. The RCo2 compounds were generally considered as model systems for understanding of basic properties of IEM intermetallics. However, microscopic nature of magnetic properties still remains unclear. In our experimental and theoretical study of ErCo2 in a wide range of thermodynamic parameters a sequential collapse of cobalt sublattice magnetization in the background of nearly unchanged Er sublattice magnetization was revealed. The uncoupled magnetizations behavior challenges the IEM concept applicability and evidences more complex nature of magnetism in ErCo2 and related RCo2 systems.

2.
J Phys Condens Matter ; 27(11): 115503, 2015 Mar 25.
Artigo em Inglês | MEDLINE | ID: mdl-25738224

RESUMO

The results of the electronic structure calculations performed on SmN by using the LDA+U method with and without including the spin-orbit coupling are presented. Within the LDA+U approach, a N(2p) band polarization of about 0.3 µB is induced by Sm(4f)-N(2p) hybridization, and a half-metallic ground state is obtained. By including spin-orbit coupling the magnetic structure was shown to be antiferromagnetic of type II, with Sm spin and orbital moments nearly cancelling. This results into a semiconducting ground state, which is in agreement with experimental results.

3.
J Phys Condens Matter ; 23(2): 026001, 2011 Jan 19.
Artigo em Inglês | MEDLINE | ID: mdl-21406851

RESUMO

Magnetic measurements and band structure calculations were performed on RT(2) and RT(5) compounds, where R is a heavy rare-earth and T = Fe, Co, Ni, Al, as well as on pseudobinary compounds GdCo(2 - x)A(x) (A = Ni, Cu, Si), YFe(2 - x)V(x) and YCo(4 - x)Ni(x)B. The calculated moments per formula unit described well the experimentally determined magnetizations. By considering the 4f-5d-3d exchange interactions, we evaluate the contributions of local 4f-5d and short range 5d-3d interactions to R 5d and Y 4d band polarizations. The 4f-5d induced polarizations are proportional to the De Gennes factor and are the same for a given R and a similar type structure. The R 5d and Y 4d band polarizations induced by R 5d-T3d or Y 4d-T3d hybridizations are proportional to the number of neighbouring T atoms, to a given R, and their magnetic moments. Previous results on the matter are also discussed.


Assuntos
Magnetismo , Metais Terras Raras/química , Elementos de Transição/química , Modelos Moleculares
4.
Phys Rev Lett ; 100(8): 086402, 2008 Feb 29.
Artigo em Inglês | MEDLINE | ID: mdl-18352640

RESUMO

We investigate the effects of electronic correlations in the full-Heusler Co2MnSi, by combining a theoretical analysis of the spin-resolved density of states with tunneling-conductance spectroscopy measurements using Co2MnSi as electrode. Both experimental and theoretical results confirm the existence of so-called nonquasiparticle states and their crucial contribution to the finite-temperature spin polarization in this material.

5.
J Phys Condens Matter ; 20(27): 275201, 2008 Jul 09.
Artigo em Inglês | MEDLINE | ID: mdl-21694363

RESUMO

Magnetic measurements were performed in the temperature range 4.2-300 K and fields up to 70 kOe on R(3)Ni(7)B(2) compounds with R = Gd, Tb, Dy, Ho, Er. The Curie temperatures decrease from 38.5 K (Gd) to 7 K (Er). Band structure calculations show that nickel, at 0 K, has a very small magnetic polarization, oriented antiparallel to the rare-earth moment. The XPS measurements suggest the presence of unoccupied Ni3d states. The reciprocal susceptibilities follow a Curie-Weiss type behaviour. Effective nickel moments of 1.33 ± 0.25 µ(B) were determined. The magnetic behaviour of nickel is analysed in models which take into account electron correlation effects in d bands.

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