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The magnetic properties in the parent compounds are often intimately related to the microscopic mechanism of superconductivity. Here we report the first direct measurements on the electronic structure of a parent compound of the newly…

The atomic structures, electronic band structures and magnetic properties of monolayer FeSe and FeSe$_{0.5}$Te$_{0.5}$ of different configurations have been systematically investigated via first-principles calculations with the inclusion of…

Mesoscale and Nanoscale Physics · Physics 2016-11-23 Menglei Li , Fawei Zheng , Ping Zhang

We report on inelastic neutron scattering measurements that find incommensurate itinerant like magnetic excitations in the normal state of superconducting FeTe$_{0.6}$Se$_{0.4}$ (\Tc=14K) at wave-vector…

The electronic and magnetic properties of the mother material LaOFeAs of new superconductors have been carefully studied using first-principles electronic structure calculations based on the generalized gradient approximation in the density…

Superconductivity · Physics 2009-11-13 Shoji Ishibashi , Kiyoyuki Terakura , Hideo Hosono

By simultaneous Co and Ca-doping we were able to obtain an $\ce{EuFe2As2}$-based compound with superconductivity appearing above the antiferromagnetic order of $\ce{Eu^{2+}}$ magnetic moments. However, as soon as the antiferromagnetic order…

Superconductivity · Physics 2024-02-07 Lan Maria Tran , Andrzej J. Zaleski , Zbigniew Bukowski

In heavy-fermion compounds, the dual character of $f$ electrons underlies their rich and often exotic properties like fragile heavy quasipartilces, variety of magnetic orders and unconventional superconductivity. 5$f$-electron actinide…

Strongly Correlated Electrons · Physics 2019-09-13 Q. Y. Chen , X. B. Luo , D. H. Xie , M. L. Li , X. Y. Ji , R. Zhou , Y. B. Huang , W. Zhang , W. Feng , Y. Zhang , X. G. Zhu , Q. Q. Hao , Q. Liu , L. Huang , P. Zhang , X. C. Lai , Q. Si , S. Y. Tan

Antiferroelectricity (AFE) is a fundamental concept in physics and materials science. Conventional AFEs have the picture of alternating local electric dipoles defined in real space. Here, we discover a new class of AFEs, termed type-II…

Materials Science · Physics 2026-03-26 Yang Wang , Zhi-Ming Yu , Chaoxi Cui , Yilin Han , Tingli He , Weikang Wu , Run-Wu Zhang , Shengyuan A. Yang , Yugui Yao

I present a brief overview on the interplay between magnetism and superconductivity in one of the Fe-based superconductor systems, \fts, where the research of our group has centered. The parent compound Fe$_{1+y}$Te is an antiferromagnet;…

Superconductivity · Physics 2015-06-05 Jinsheng Wen

Obtaining the electronic structure of the newly discovered iron-based superconductors is the key to understanding the mechanism of their high-temperature superconductivity. We used angle-resolved photoemission spectroscopy (ARPES) to make…

In the novel stoichiometric iron-based material RbEuFe$_{4}$As$_{4}$ superconductivity coexists with a peculiar long-range magnetic order of Eu 4f states. Using angle-resolved photoemission spectroscopy, we reveal a complex three…

Electronic and magnetic structures of the newly synthesized cobalt oxyselenide La2Co2Se2O3 (structurally similar to the superconducting iron pnictides) are studied through density functional calculations. The obtained results show that this…

Strongly Correlated Electrons · Physics 2015-05-19 Hua Wu

Electronic properties of molecular conductors exhibiting antiferromagnetic (AFM) spin order and charge order (CO) owing to electron correlation are studied using first-principles density functional theory calculations. We investigate two…

Strongly Correlated Electrons · Physics 2024-11-21 Takao Tsumuraya , Tsuyoshi Miyazaki , Hitoshi Seo

Electronic nematicity is an important order in most iron-based superconductors, and FeSe represents a unique example, in which nematicity disentangles from spin ordering. It is commonly perceived that this property arises from strong…

Strongly Correlated Electrons · Physics 2020-07-30 Xuanyu Long , Shunhong Zhang , Fa Wang , Zheng Liu

The V-based kagome systems AV3Sb5 (A = Cs, Rb and K) are unique by virtue of the intricate interplay of non-trivial electronic structure, topology and intriguing fermiology, rendering them to be a playground of many mutually dependent…

The electronic properties of two spinels Fe$_3$O$_4$ and Fe$_2$SiO$_4$ are studied by the density functional theory. The local Coulomb repulsion $U$ and the Hund's exchange $J$ between the $3d$ electrons on iron are included. For $U=0$,…

Strongly Correlated Electrons · Physics 2010-07-15 P. Piekarz , A. M. Oleś , K. Parlinski

We have studied electronic and magnetic structures of K$_{0.8+x}$Fe$_{1.6}$Se$_2$ by performing the first-principles electronic structure calculations. The ground state of the Fe-vacancies ordered K$_{0.8}$Fe$_{1.6}$Se$_2$ is found to be a…

Superconductivity · Physics 2011-06-17 Xun-Wang Yan , Miao Gao , Zhong-Yi LU , Tao Xiang

Much remains unknown of the microscopic origin of superconductivity when it materializes in atomically disordered systems as in amorphous alloys (1) or in crystals riddled with defects(2). A manifestation of this conundrum is envisaged in…

Superconductivity · Physics 2013-02-12 Despina Louca , Keeseong Park , Bing Li , Joerg Neuefeind , Jiaqiang Yan

The density functional non-interacting susceptibility has been analyzed in different phases of CaFe2As2 and compared with similar data for pure d-metals. The conditions for the "no local moment" itinerant state with large frustrations are…

Superconductivity · Physics 2009-11-13 G. D. Samolyuk , V. P. Antropov

Here we present microscopic evidence of the persistence of uniaxial A-type antiferromagnetic order to the surface layers of MnBi$_2$Te$_4$ single crystals using magnetic force microscopy. Our results reveal termination-dependent magnetic…

Materials Science · Physics 2020-07-15 Paul M. Sass , Jinwoong Kim , David Vanderbilt , Jiaqiang Yan , Weida Wu

Kagome materials often host exotic quantum phases, including spin liquids, Chern gap, charge order, and superconductivity. Existing scanning microscopy studies of the kagome charge order have been limited to non-kagome surface layers. Here…