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Two-dimensional (2D) Fe-chalcogenides with rich structures, magnetisms and superconductivities are highly desirable to reveal the torturous transition mechanism and explore their potential applications in spintronics and nanoelectronics.…

Two-dimensional (2D) crystals, such as graphene, hexagonal boron nitride and transitional metal dichalcogenides, have attracted tremendous amount of attention over the past decade due to their extraordinary thermal, electrical and optical…

Materials Science · Physics 2017-02-16 Y. Zhao , Z. Wan , U. Hetmaniuk , M. P. Anantram

Two-dimensional (2D) transition metal dichalcogenides (TMDs), especially MoS2 and WS2 recently attract extensive attentions due to their rich physics and great potential applications. Superior to graphene, MS2 (M = Mo/W) monolayers have a…

Materials Science · Physics 2013-12-06 Chunxiao Cong , Jingzhi Shang , Xing Wu , Bingchen Cao , Namphung Peimyoo , Caiyu Qiu , Litao Sun , Ting Yu

Loop arrangements and their quantum superpositions describe several interesting many-particle states. We propose that they also describe bonding in a class of transition metal dichalcogenides. We present an effective quantum loop model for…

Strongly Correlated Electrons · Physics 2025-05-06 Ashland Knowles , G. Baskaran , R. Ganesh

Layered delafossite-type magnetic materials, such as KCrSe$_2$, are promising platforms for studying magnetic systems and potential frustration on triangular lattices. Synthesis, structure-type control, and off-stoichiometries remain major…

Materials Science · Physics 2025-11-18 Felix Eder , Catherine Witteveen , Enrico Giannini , Fabian O. von Rohr

Due to the large spin-orbital coupling in the layered 5d-transition metal chalcogenides compound, the occurrence of superconductivity in Ir2-xPdxTe2 offers a good chance to search for possible topological superconducting states in this…

Plate-like single crystals of SrFe2As2 as large as 3x3x0.5 mm3 have been grown out of Sn flux. The SrFe2As2 single crystals show a structural phase transition from a high temperature tetragonal phase to a low temperature orthorhombic phase…

Using electronic structure calculations based on density functional theory, we predict and study the structural, mechanical, electronic, magnetic and transport properties of a new full Heusler chalcogenide, namely, Fe$_2$CrTe, both in bulk…

Materials Science · Physics 2023-04-05 Joydipto Bhattacharya , Rajeev Dutt , Aparna Chakrabarti

The discovery and control of intergrowth structures represent an important avenue for the targeted synthesis of new, more complex structure types. When including magnetic framework metal atoms, this enhanced complexity can transfer to rich…

Materials Science · Physics 2026-04-14 Kai D. Röseler , Felix Eder , Fabian O. von Rohr

Two-dimensional (2D) materials, such as transition metal dichalcogenides (TMDCs) in the 2H or 1T crystal phases, are promising (electro)catalyst candidates due to their high surface to volume ratio and composition of low-cost, abundant…

Materials Science · Physics 2025-02-11 Mohammad Amin Akhound , Karsten Wedel Jacobsen , Kristian Sommer Thygesen

We calculate from first principles the electronic structure and optical properties of a number of transition metal dichalcogenide (TMD) bilayer heterostructures consisting of MoS2 layers sandwiched with WS2, MoSe2, MoTe2, BN, or graphene…

Mesoscale and Nanoscale Physics · Physics 2013-09-12 Hannu-Pekka Komsa , Arkady V. Krasheninnikov

Superconducting and structural phase transitions in a pyrochlore oxide Cd2Re2O7 are studied under high pressure by x-ray diffraction and electrical resistivity measurements. A rich P-T phase diagram is obtained, which contains at least two…

In the layered copper chromium dichalcogenide series CuCr$X_2$, the oxide, the sulfide, and the selenide analogues have been reported, but the telluride CuCrTe$_2$ has remained unsynthesized so far. Here, we report the synthesis of…

We use density functional theory based first-principles method to investigate the bandstructure and phase stability in the laterally grown hexagonal C$_x$(BN)$_{1-x}$, two-dimensional Graphene and $h$-BN hybrid nanomaterials, which were…

Mesoscale and Nanoscale Physics · Physics 2016-03-21 Ransell D'Souza , Sugata Mukherjee

Sr2Cr3As2O2 is composed of alternating square-lattice CrO2 and Cr2As2 stacking layers, where CrO2 is isostructural to the CuO2 building-block of cuprate high-Tc superconductors and Cr2As2 to Fe2As2 of Fe-based superconductors. Current…

We determined the crystal structure of Cs$_2$LiRuCl$_6$, which was synthesized first in this work, and investigated its magnetic properties. Cs$_2$LiRuCl$_6$ has a hexagonal structure composed of linear chains of face-sharing RuCl$_6$ and…

We report the synthesis of a new quasi one-dimensional (1D) iron selenide. Ba9Fe3Se15 was synthesized at high temperature and high pressure of 5.5 GPa and systematically studied via structural, magnetic and transport measurements at ambient…

We investigate the electronic and magnetic structures of two-dimensional transition metal tri-chalcogenide CrSiTe$_{3}$ and CrGeTe$_{3}$ materials by carrying out first-principles calculations. The single-layer CrSiTe$_3$ and CrGeTe$_3$ are…

Materials Science · Physics 2018-09-26 Sungmo Kang , Seungjin Kang , Jaejun Yu

We report on fabrication of large-scale arrays of suspended molybdenum disulfide (MoS2) atomic layers, as two-dimensional (2D) MoS2 nanomechanical resonators. We employ a water-assisted lift-off process to release chemical vapor deposited…

Mesoscale and Nanoscale Physics · Physics 2016-07-15 Hao Jia , Rui Yang , Ariana E. Nguyen , Sahar N. Alvillar , Thomas Empante , Ludwig Bartels , Philip X. -L. Feng

We report the growth of single crystals of SrCu2As2, SrCu2Sb2, SrCu2(As{0.84}Sb{0.16})2 and BaCu2Sb2 using the self-flux technique and their structural, magnetic, thermal and transport properties that were investigated by powder x-ray…

Superconductivity · Physics 2012-09-11 V. K. Anand , P. Kanchana Perera , Abhishek Pandey , R. J. Goetsch , A. Kreyssig , D. C. Johnston
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