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The alloying elements introduced into carbon steel to enhance its mechanical properties also diffuse into cementite (Fe$_3$C) particles, modifying their characteristics and thereby influencing the overall performance of the steel. This…

Materials Science · Physics 2026-03-24 Lyudmila V. Dobysheva

We have generalized the dynamical mean-field theory to study the doping dependence of the crossover from antiferromagnetic to short-range order modelled by an incommensurate spin density wave in the Hubbard model. The local selfenergy which…

Strongly Correlated Electrons · Physics 2009-10-31 M. Fleck , A. I. Lichtenstein , A. M. Oles , L. Hedin , V. I. Anisimov

We establish the sign of the linear magnetoelectric (ME) coefficient, $\alpha$, in chromia, Cr$_2$O$_3$. Cr$_2$O$_3$ is the prototypical linear ME material, in which an electric (magnetic) field induces a linearly proportional magnetization…

Using a combination of density functional theory (DFT) and spin-wave theory methods, we investigate the magnetic interactions and spin excitations in semiconducting VI$_3$. Exchange parameters of monolayer, bilayer, and bulk forms are…

Materials Science · Physics 2021-09-24 Elijah Gordon , V. V. Mkhitaryan , Haijun Zhao , Y. Lee , Liqin Ke

Two essential ingredients for the quantum anomalous Hall (QAH) effect, i.e. topological and magnetic orders, can be combined by doping magnetic ions into a topological insulator (TI) film. Through this approach, the QAH effect has been…

Mesoscale and Nanoscale Physics · Physics 2026-04-28 Fei Wang , Yi-Fan Zhao , Zijie Yan , Hemian Yi , Wei Yuan , Lingjie Zhou , Weiwei Zhao , Moses H. W. Chan , Cui-Zu Chang

We study the electronic and magnetic properties of monolayer Fe$_3$GeTe$_2$ within the DFT+DMFT approach in the paramagnetic phase. We argue that this compound is sufficiently far from the local magnetic moment limit, demonstrating…

Strongly Correlated Electrons · Physics 2026-03-13 A. A. Katanin , A. N. Rudenko , D. I. Badrtdinov , M. I. Katsnelson

The physical systems with ferromagnetism and "bad" metallicity hosting unusual transport properties are playgrounds of novel quantum phenomena. Recently EuTi$_{1-x}$Nb$_x$O$_3$ emerged as a ferromagnetic system where non-trivial temperature…

We use molecular beam epitaxy to develop a gate tunable p-n heterojunction that interfaces a canonical Dirac semimetal, Cd$_3$As$_2$, and a ferromagnetic semiconductor, In$_{1-x}$Mn$_x$As, with perpendicular magnetic anisotropy.…

Using polarization-resolved Raman spectroscopy, we investigate layer number, temperature, and magnetic field dependence of Raman spectra in one- to four-layer $\mathrm{CrI_{3}}$. Layer-number-dependent Raman spectra show that in the…

The longitudinal magnetic susceptibility of single crystals of the molecular magnet Mn$_{12}$-acetate obeys a Curie-Weiss law, indicating a transition to a ferromagnetic phase due to dipolar interactions. With increasing magnetic field…

Mesoscale and Nanoscale Physics · Physics 2010-09-02 Bo Wen , P. Subedi , Lin Bo , Y. Yeshurun , M. P. Sarachik , A. D. Kent , C. Lampropoulos , G. Christou

The effect of electron doping on the structural, transport, and magnetic properties of Mn (IV) - rich Ca1-xYxMnO3 (x < 0.2) samples have been investigated using neutron diffraction, neutron depolarization, magnetization and resistivity…

Materials Science · Physics 2016-02-09 Neetika Sharma , A. Das , C. L. Prajapat , Amit Kumar , M. R. Singh

The samples of Ga doped Cr2O3 oxide have been prepared using chemical co-precipitation route. X-ray diffraction pattern and Raman spectra have confirmed rhombohedral crystal structure with space group R3-C. Magnetic measurement has…

Materials Science · Physics 2017-03-08 R. N. Bhowmik , K. Venkata Siva , R. Ranganathan , Chandan Mazumdar

By using first principles calculations we report a chemical doping induced gap in graphene. The structural and electronic properties of CrO$_3$ interacting with graphene layer are calculated using ab initio methods based on the density…

Materials Science · Physics 2007-11-08 I. Zanella S. Guerini , S. B. Fagan , J. Mendes Filho , A. G. Souza Filho

Finding and designing ferromagnets that operate above room temperature is crucial in advancing high-performance spintronic devices. The pioneering van der Waals (vdW) ferromagnet Fe$_{3}$GaTe$_{2}$ has extended the way for spintronic…

Materials Science · Physics 2025-04-25 Yuanji Xu , Xintao Jin , Jiacheng Xiang , Huiyuan Zhang , Fuyang Tian

Using a cluster extension of the dynamical mean-field theory, we show that strongly correlated metals subject to Hund's physics exhibit significant electronic structure modulations above magnetic transition temperatures. In particular, in a…

Strongly Correlated Electrons · Physics 2022-05-24 Yusuke Nomura , Shiro Sakai , Ryotaro Arita

Chromium trihalides (CrI$_3$, CrBr$_3$ and CrCl$_3$) form a prominent family of isostructural insulating layered materials in which ferromagnetic order has been observed down to the monolayer. Here we provide a comprehensive computational…

Materials Science · Physics 2021-03-30 A. Molina-Sánchez , G. Catarina , D. Sangalli , J. Fernández-Rossier

In this work we investigate doping and temperature dependences of electronic structure of system with strong electronic correlations and strong electron-phonon interaction modeling cuprates in the frameworks of the three-band p-d-Holstein…

Strongly Correlated Electrons · Physics 2016-12-09 I. A. Makarov , S. G. Ovchinnikov

Understanding spin control mechanisms is an important part of condensed matter physics and the theoretical basis for designing spintronic devices. In this letter, based on four-sublattices molecular field theory, we propose that the…

Materials Science · Physics 2022-07-11 Jiyu Shen , Jiajun Mo , Zeyi Lu , Huilin Huang , Chenying Gong , Yi Long , Arramel , Yanfang Xia , Min Liu , Jizhou Jiang

Fe$_3$GaTe$_2$, a recently discovered van der Waals ferromagnet, demonstrates intrinsic ferromagnetism above room temperature, necessitating a comprehensive investigation of the microscopic origins of its high Curie temperature…

We study the spin-crossover molecule Fe(phen)$_2$(NCS)$_2$ using density functional theory (DFT) plus dynamical mean-field theory, which allows access to observables not attainable with traditional quantum chemical or electronic structure…

Materials Science · Physics 2015-06-30 Jia Chen , Andrew Millis , Chris Marianetti
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