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The classical Heisenberg model is applied in a Monte Carlo study to investigate the distance dependence of the indirect nearest neighbor (NN) exchange and next-nearest neighbor (NNN) superexchange interaction in EuO, EuS, EuSe and EuTe. For…

Materials Science · Physics 2010-05-10 W. Söllinger , W. Heiss , R. T. Lechner , K. Rumpf , P. Granitzer , H. Krenn , G. Springholz

Half-metallic ferromagnetic full-Heusler alloys containing Co and Mn, having the formula Co$_2$MnZ where Z a sp element, are among the most studied Heusler alloys due to their stable ferromagnetism and the high Curie temperatures which they…

Materials Science · Physics 2007-09-01 K. Ozdogan , I. Galanakis , E. Sasioglu , B. Aktas

The RCo2Mn (R= Ho and Er) alloys, crystallizing in the cubic MgCu2-type structure, are isostructural to RCo2 compounds. The excess Mn occupies both the R and the Co atomic positions. Magnetic, electrical and heat capacity measurements have…

Strongly Correlated Electrons · Physics 2015-05-14 Bibekananda Maji , K. G. Suresh , A. K. Nigam

The electronic structure and magnetic exchange interactions in pure and V-doped Fe16N2 are studied within the framework of density functional theory. The Curie temperatures were obtained with both mean field approximation (MFA) as well as…

Materials Science · Physics 2018-10-24 Satadeep Bhattacharjee , Seung-Cheol Lee

We have investigated the critical phenomenon associated with the magnetic phase transition in the half-metallic full-Heusler Co$_2$TiGe. The compound undergoes a continuous ferromagnetic to paramagnetic phase transition at the Curie…

Materials Science · Physics 2019-06-11 Shubhankar Roy , Nazir Khan , Ratnadwip Singha , Arnab Pariari , Prabhat Mandal

The magnetic properties of dilute magnetic semiconductors (DMS) are calculated from first-principles by mapping the ab initio results on a classical Heisenberg model. It is found that the range of the exchange interaction in (Ga, Mn)N is…

Materials Science · Physics 2007-05-23 K. Sato , W. Schweika , P. H. Dederichs , H. Katayama-Yoshida

Quadruple perovskites ACu$_3$Fe$_2$Re$_2$O$_{12}$ attract considerable interest due to their high Curie temperatures (up to $710$K), which strongly depend on the A-site cation. In this work, we employ first-principles calculations to…

We investigate the effect of chemical disorder on the magnetic exchange couplings and the Curie temperature ($T_{\text{c}}$) in L1$_0$-ordered FeNi using first-principles-based calculations. We use supercells to model chemical disorder, to…

Materials Science · Physics 2022-05-11 Ankit Izardar , Claude Ederer

Based on first-principles electron structure calculations and employing the frozen-magnon approximation we study the exchange interactions in a series of transition-metal binary alloys crystallizing in the zinc-blende structure and…

Materials Science · Physics 2009-11-11 E. Sasioglu , I. Galanakis , L. M. Sandratskii , P. Bruno

Prediction of the Curie temperature is of significant importance for the design of ferromagnetic materials. Even though the Curie temperature has been estimated using the Heisenberg model, magnetic exchange coupling parameters widely used…

Materials Science · Physics 2020-12-08 Tomonori Tanaka , Yoshihiro Gohda

The electronic properties, exchange interactions, finite-temperature magnetism, and transport properties of random quaternary Heusler Ni$_{2}$MnSn alloys doped with Cu- and Pd-atoms are studied theoretically by means of {\it ab initio}…

Materials Science · Physics 2015-05-19 S. K. Bose , J. Kudrnovský , V. Drchal , I. Turek

The two-dimensional (2D) van der Waals ferromagnetic semiconductors, such as CrI$_3$ and Cr$_2$Ge$_2$Te$_6$, and the 2D ferromagnetic metals, such as Fe$_3$GeTe$_2$ and MnSe$_2$, have been obtained in recent experiments and attracted a lot…

Materials Science · Physics 2023-12-29 Jia-Wen Li , Zhen Zhang , Jing-Yang You , Bo Gu , Gang Su

We present a data set of calculated Curie temperatures for the main-phase compounds of rare-earth permanent magnets. We employ ab initio electronic structure calculations for the itinerant ferromagnetism and an effective spin model for the…

Materials Science · Physics 2020-04-28 Munehisa Matsumoto , Hisazumi Akai

Magnetization, neutron diffraction and X-ray diffraction of Zn doped MnV2O4 as a function of temperature have been measured and the critical exponents and magnetocaloric effect of this system have been estimated. It is observed, that with…

The high-temperature ferromagnet MnBi continues to receive attention as a candidate to replace rare-earth-containing permanent magnets in applications above room temperature. This is due to a high Curie temperature, large magnetic moments,…

Strongly Correlated Electrons · Physics 2016-05-12 T. J. Williams , A. E. Taylor , A. D. Christianson , S. E. Hahn , R. S. Fishman , D. S. Parker , M. A. McGuire , B. C. Sales , M. D. Lumsden

In this work a simple concept was used for a systematic search for new materials with high spin polarization. It is based on two semi-empirical models. Firstly, the Slater-Pauling rule was used for estimation of the magnetic moment. This…

The magnetic state of Nitrogen-doped MgO, with N substituting O at concentrations between 1% and the concentrated limit, is calculated with density-functional methods. The N atoms are found to be magnetic with a moment of 1 Bohr magneton…

Materials Science · Physics 2009-11-13 Phivos Mavropoulos , Marjana Lezaic , Stefan Blügel

The temperature dependence of magnetization and specific heat of the ferromagnetic compound DyFe2Zn20 has been measured in detail in various magnetic fields. We have observed anomalous magnetic behavior, i.e., a strong anisotropy at 2 K,…

The Pair Approximation method is applied to studies of the bilayer and multilayer magnetic systems with simple cubic structure. The method allows to take into account quantum effects related with non-Ising couplings. The paper adopts the…

Statistical Mechanics · Physics 2013-04-09 Karol Szałowski , Tadeusz Balcerzak

We present a model study of ferromagnetic films consisting of free Bloch electrons coupled to localized moments (Kondo lattice films). By mapping the local interaction onto an effective Heisenberg Hamiltonian we obtain temperature and…

Strongly Correlated Electrons · Physics 2007-05-23 Jochen Kienert , Wolfgang Nolting