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We find, through first-principles calculations, that hole doping induces a ferromagnetic phase transition in monolayer GaSe. Upon increasing hole density, the average spin magnetic moment per carrier increases and reaches a plateau near 1.0…

Mesoscale and Nanoscale Physics · Physics 2015-06-17 Ting Cao , Zhenglu Li , Steven G. Louie

We use molecular dynamics simulations to understand the mechanisms of polarization switching in ferroelectric BaTiO$_3$ achieved with external electric field. For tetragonal and orthorhombic ferroelectric phases, we determine the switching…

Materials Science · Physics 2009-11-13 Jaita Paul , Takeshi Nishimatsu , Yoshiyuki Kawazoe , Umesh V. Waghmare

Doped SrTiO3 becomes a metal at extremely low doping concentrations n and is even superconducting with the superconducting transition temperature adopting a dome-like shape with the carrier concentration. It is shown here within the…

Materials Science · Physics 2019-10-08 Annette Bussmann-Holder , Hugo Keller , Arndt Simon , Krystian Roleder , Krzysztof Szot

To resolve the microscopic origin of magnetism in the Fe2O3/FeTiO3-system, we have performed density functional theory calculations taking into account on-site Coulomb repulsion. By varying systematically the concentration, distribution and…

Materials Science · Physics 2009-09-23 Rossitza Pentcheva , Hasan Sadat Nabi

We theoretically study the emergence of topological magnons in electron-magnon coupled systems. The magnon dispersion in a ferromagnet usually possesses an effective time reversal symmetry in the absence of Dzyaloshinskii-Moriya (DM)…

Strongly Correlated Electrons · Physics 2026-02-02 Kosuke Fujiwara , Takahiro Morimoto

Recent advances in electrostatic gating provide a novel way to modify the carrier concentration in materials via electrostatic means instead of chemical doping, thus minimizing the impurity scattering. Here, we use first-principles Density…

Materials Science · Physics 2020-05-13 Ezra Day-Roberts , Turan Birol , Rafael M. Fernandes

Possible ferromagnetism induced in otherwise non-magnetic materials has been motivating intense research in complex oxide heterostructures. Here we show that a confined magnetism is realized at the interface between SrTiO3 and two…

We explore the interplay between ferroelectricity and metallicity, which are generally considered to be contra-indicated properties, in the prototypical ferroelectric barium titanate, BaTiO$_3$. Using first-principles density functional…

Materials Science · Physics 2025-07-22 Veronica F. Michel , Tobias Esswein , Nicola A. Spaldin

Doped perovskite cobaltites (e.g., La$_{1-x}$Sr$_x$CoO$_3$) have been extensively studied for their spin-state physics, electronic inhomogeneity, and insulator-metal transitions. Ferromagnetically-interacting spin-state polarons emerge at…

Strongly Correlated Electrons · Physics 2021-05-14 Peter P. Orth , Daniel Phelan , J. Zhao , H. Zheng , J. F. Mitchell , C. Leighton , Rafael M. Fernandes

Creating and manipulating spin polarization in low-dimensional electron systems (such as two-dimensional electron gases) is fundamentally essential for spintronic applications, which is yet a challenge to date. In this work, we establish…

Strongly Correlated Electrons · Physics 2020-01-22 Ruyi Zhang , Yujuan Pei , Yang Song , Jiachang Bi , Jingkai Yang , Junxi Duan , Yanwei Cao

Understanding the magnetic properties of the various Mn doping configurations that can be encountered in $2H$-MoS$_2$ monolayer could be beneficial for its use in spintronics. Using density functional theory plus Hubbard U (DFT$+$U)…

Materials Science · Physics 2019-09-04 Adlen Smiri , Iann Gerber , Samir Lounis , Sihem Jaziri

Ferroelectric and ferromagnetic orders rarely coexist, and magnetoelectric coupling is even more scarce. A possible avenue for combining these orders is by interface design, where orders formed at the constituent materials can overlap and…

Strongly Correlated Electrons · Physics 2022-04-12 Gal Tuvia , Sapir Weitz Sobelman , Shay Sandik , Beena Kalisky , Yoram Dagan

In a recent publication (S. Dong et al., Phys. Rev. Lett.103, 127201 (2009)), two (related) mechanisms were proposed to understand the intrinsic exchange bias present in oxides heterostructures involving G-type antiferromagnetic…

Materials Science · Physics 2012-01-04 Shuai Dong , Qinfang Zhang , Seiji Yunoki , J. -M. Liu , Elbio Dagotto

The exchange bias (EB) effect, pivotal in magnetic data storage and sensing devices, has been observed not only in interfacial regions but also in intrinsic ferromagnetic materials. Here, we've uncovered a robust and stable exchange bias…

Materials Science · Physics 2023-12-29 Xi Zhang , Xiuquan Xia , Qiye Liu , Yonggang He , Le Wang , Junhao Lin , Jia-Wei Mei , Yingchun Cheng , Jun-Feng Dai

Guided by the internal-reference rule and the known band offsets in III-V and II-VI diluted magnetic semiconductors, we discuss the feasibility of obtaining p-type conductivity, required for the carrier-induced ferromagnetism, as well as…

Materials Science · Physics 2007-05-23 J. Blinowski , P. Kacman , T. Dietl

We have studied the magnetic and transport behavior of doped La0.65 A0.35 Mn0.95Fe0.05 O3 (A= Ca, Sr, Pb, Ba) compounds. All the compositions show ferromagnetic/metal to paramagnetic/insulator transition except the Pb doped sample which is…

Strongly Correlated Electrons · Physics 2010-11-11 Wiqar Hussain Shah

Topological insulators (TIs) are materials with an insulating bulk characterized by a gapped band structure, along with gapless metallic surface states having a Dirac cone with a helical spin structure in momentum space. The helical…

Materials Science · Physics 2024-09-02 Sumana Paul , Moumita Das , Sujoy Datta , Raja Chakraborty , Prabhat Mandal , P. K. Giri

Electric-field driven magnetization switching in FePt/BaTiO$_3$ (001) is demonstrated through first-principles calculations. The magnetic easy axis of FePt layer undergoes a transition from in-plane to perpendicular direction upon…

Materials Science · Physics 2026-02-05 Qurat-ul-ain , Thi H. Ho , Soon Cheol Hong , Dorj Odkhuu , S. H. Rhim

The interaction between the electronic and structural degrees of freedom is central to several intriguing phenomena observed in condensed-matter physics. In magnetic materials, magnetic interactions couple to lattice degrees of freedom,…

Layered ruthenates are a unique class of systems which manifests a variety of electronic and magnetic features emerged from competing energy scales. At the heart of such features lies the multi-orbital physics, especially, the…

Strongly Correlated Electrons · Physics 2022-11-08 Minjae Kim , Chang-Jong Kang , Jae-Ho Han , Kyoo Kim , Bongjae Kim