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First principle FLAPW-GGA calculations have been performed with the purpose to understand the electronic properties for the newly synthesized tetragonal (space group P4/nmm) layered iron arsenide-oxide: Sr4Sc2Fe2As2O6 doped with titanium.…

Superconductivity · Physics 2009-04-02 I. R. Shein , A. L. Ivanovskii

Currently, topological semimetals are being actively investigated from both theoretical and experimental perspectives due to their unique physical properties, including topologically protected states, large magnetoresistivity, and high…

New intercalation compounds Cr$_x$ZrTe$_2$ were synthesized in the Cr concentration range of x=0-0.3. A thorough study of the crystal and electronic structure has been performed. It was found that there is competition in the distribution of…

First principles FLAPW-GGA method was used for the comparative study of the structural and electronic properties of three related tetragonal ThCr2Si2-type phases KFe2Ch2, where Ch are S, Se, and Te. The main trends in electronic bands,…

Superconductivity · Physics 2011-02-23 I. R. Shein , A. L. Ivanovskii

Altermagnetism is an emerging series of unconventional magnetic materials characterized by time-reversal symmetry breaking and spin-split bands in the momentum space with zero net magnetization. Metallic altermagnets offer unique advantages…

Materials Science · Physics 2025-02-20 Weiwei Sun , Mingzhuang Wang , Baisheng Sa , Shaui Dong , Carmine Autieri

Locally noncentrosymmetric CeRh$_{2}$As$_{2}$ exhibits characteristic two-phase unconventional $H$--$T$ superconducting phase diagram. The transition from even- to odd-parity superconducting phase is supported by the P4/nmm crystal…

Superconductivity · Physics 2023-11-03 Konrad Jerzy Kapcia , Andrzej Ptok

We present an analysis of bulk and surface electronic structures of thallium based ternary III-V-VI$_2$ series of compounds TlMQ$_2$, where M=Bi or Sb and Q=S, Se or Te, using the ab initio density functional theory framework. Based on…

Mesoscale and Nanoscale Physics · Physics 2012-09-27 Bahadur Singh , Ashutosh Sharma , H. Lin , M. Z. Hasan , R. Prasad , A. Bansil

Electrical control of magnetism of a ferromagnetic semiconductor offers exciting prospects for future spintronic devices for processing and storing information. Here, we report observation of electrically modulated magnetic phase transition…

Mesoscale and Nanoscale Physics · Physics 2020-06-19 Ivan. A. Verzhbitskiy , Hidekazu Kurebayashi , Haixia Cheng , Jun Zhou , Safe Khan , Yuan Ping Feng , Goki Eda

The study of magnetic phenomena in low-dimensional systems has largely explored after the discovery of two-dimensional (2D) magnetic materials, such as CrI3 and Cr2Ge2Te6 in 2017. These materials presents intrinsic magnetic order,…

General Physics · Physics 2025-04-08 Chee Kian Yap , Arun Kumar Singh

The layered transition metal chalcogenides have been a fertile land in solid state physics for many decades. Various MX2-type transition metal dichalcogenides, such as WTe2, IrTe2, and MoS2, have triggered great attention recently, either…

Two-dimensional (2D) van der Waals (vdW) materials show a range of profound physical properties that can be tailored through their incorporation in heterostructures and manipulated with external forces. The recent discovery of long-range…

The interplay between magnetic order and electronic topology in van der Waals materials enables extreme responses to external stimuli. The nodal-line semiconductor Mn3Si2Te6 exemplifies this, exhibiting colossal angular magnetoresistance…

The electronic structure of high-quality van der Waals multiferroic CuCrP$_2$S6 crystals was investigated applying photoelectron spectroscopy methods in combination with DFT analysis. Using X-ray photoelectron and near-edge X-ray absorption…

The new-found two-dimensional antiferromagnetic GdTe$_3$ is attractive owing to its highest carrier mobility among all known layered magnetic materials, as well as its potential application for novel magnetic twistronic and spintronic…

Materials Science · Physics 2020-10-28 J. S. Liu , S. C. Huan , Z. H. Liu , W. L. Liu , Z. T. Liu , X. L. Lu , Z. Huang , Z. C. Jiang , X. Wang , N. Yu , Z. Q. Zou , Y. F. Guo , D. W. Shen

We report structural, physical properties and electronic structure of van der Waals (vdW) crystal VI3. Detailed analysis reveals that VI3 exhibits a structural transition from monoclinic C2/m to rhombohedral R-3 at Ts ~ 79 K, similar to…

Materials Science · Physics 2019-06-19 Shangjie Tian , Jian-Feng Zhang , Chenghe Li , Tianping Ying , Shiyan Li , Xiao Zhang , Kai Liu , Hechang Lei

Two-dimensional (2D) ferroelectric materials provide a promising platform for the electrical control of quantum states. In particular, due to their 2D nature, they are suitable for influencing the quantum states of deposited molecules via…

We successfully synthesized a novel intermetallic compound $\rm CrFe_2Ge_2$ with the $\rm Fe_{13}Ge_{8}$-type crystal structure. A structural study is presented combining single-crystal X-ray diffraction and M\"{o}ssbauer spectroscopy…

Strongly Correlated Electrons · Physics 2025-12-19 P. L. S. Cambalame , B. J. C. Vieira , J. C. Waerenborgh , P. S. P. da Silva , J. A. Paixão

The growing family of two-dimensional (2D) materials that are now available can be used to assemble van der Waals heterostructures with a wide range of properties. Of particular interest are tunnelling heterostructures, which have been used…

Motivated by the observation of nonmetallic nature in double perovskite Ca2CrReO6 and Ca2FeReO6 with high magnetic Curie temperatures of 360 and 522 K, we systematically investigate the structural, electronic, and magnetic properties of…

Materials Science · Physics 2015-11-11 Sai Gong , San-Dong Guo , Peng Chen , Bang-Gui Liu

Recently, layered copper chalcogenides Cu2X family (X=S, Se, Te) has attracted tremendous research interests due to their high thermoelectric (TE) performance, which is partly due to the superionic behavior of mobile Cu ions, making these…

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