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The electronic and magnetic properties of the new hydride superconductor CaFeAsH, which superconducts up to 47 K when electron-doped with La, and the isovalent alloy system CaFeAsH$_{1-x}$F$_x$ are investigated using density functional…

Strongly Correlated Electrons · Physics 2016-06-09 Y. N. Huang , D. Y. Liu , L. J. Zou , W. E. Pickett

According to the Bardeen-Cooper-Schrieffer (BCS) theory, superconductivity usually needs well defined Fermi surface(s) with strong electron-phonon coupling and moderate quasiparticle density of states (DOS). A kagome lattice can host flat…

Superconductivity · Physics 2023-02-22 Qing Li , Yuxiang Wu , Xinwei Fan , Ying-Jie Zhang , Xiyu Zhu , Zhengyan Zhu , Yiwen Li , Hai-Hu Wen

The films of FeSe on substrates have attracted attention because of their unusually high-temperature (Tc) superconducting properties whose origins continue to be debated. To disentangle the competing effects of the substrate and interlayer…

Superconductivity · Physics 2023-02-21 Jia Shi , Duy Le , Volodymyr Turkowski , Naseem Ud Din , Tao Jiang , Qiang Gu , Talat S. Rahman

Magnetic spin fluctuations is one candidate to produce the bosonic modes that mediate the superconductivity in the ferrous superconductors. Up until now, all of the LaOFeAs and BaFe2As2 structure types have simple commensurate magnetic…

We present results of LDA calculations (band structure, densities of states, Fermi surfaces) for possible iron based superconductor BaFe2Se3 (Ba123) in normal (paramagnetic) phase. Results are briefly compared with similar data on prototype…

Superconductivity · Physics 2013-03-29 M. V. Medvedev , I. A. Nekrasov , M. V. Sadovskii

We report a detailed study of the electronic and structural properties of the 39K superconductor \mgbtwo and of several related systems of the same family, namely \mgalbtwo, \bebtwo, \casitwo and \cabesi. Our calculations, which include…

Superconductivity · Physics 2009-11-07 G. Satta , G. Profeta , F. Bernardini , A. Continenza , S. Massidda

We report first-principles calculations on the normal and superconducting state of CaBe(x)Si(2-x) (x=1), in the framework of density functional theory for superconductors (SCDFT). CaBeSi is isostructural and isoelectronic to MgB2 and this…

Superconductivity · Physics 2013-05-29 C. Bersier , A. Floris , A. Sanna , G. Profeta , A. Continenza , E. K. U. Gross , S. Massidda

Exploration of new superconductors has always been one of the research directions in condensed matter physics. We report here a new layered heterostructure of [(Fe,Al)(OH)2][FeSe]1.2, which is synthesized by the hydrothermal ion-exchange…

The electronic structure of Ba$_2$Ti$_2$Fe$_2$As$_4$O, a newly discovered superconductor, is investigated using first-principles calculations based on local density approximations. Multiple Fermi surface sheets originating from Ti-3$d$ and…

Superconductivity · Physics 2012-07-31 Hao Jiang , Yun-Lei Sun , Jianhui Dai , Guang-Han Cao , Chao Cao

We have synthesized polycrystalline samples and single crystals of Fe(Te1-xSx)y, and characterized their properties. Our results show that the solid solution of S in this system is limited, < 30%. We observed superconductivity at ~ 9 K in…

Superconductivity · Physics 2008-11-24 M. H. Fang , B. Qian , H. M. Pham , J. H. Yang , T. J. Liu , E. K. Vehstedt , L. Spinu , Z. Q. Mao

The lattice dynamics and the effect of pressure on superconducting LiFeAs in both nonmagnetic (NM) and striped antiferromagnetic (SAF) phases are investigated using the plane-wave pseudopotential, density-functional-based method. While the…

Superconductivity · Physics 2010-07-13 G. Q. Huang , Z. W. Xing , D. Y. Xing

We prepare single layer potassium-doped iron selenide (110) film by molecular beam expitaxy. Such a single layer film can be viewed as a two-dimensional system composed of weakly coupled two-leg iron ladders. Scanning tunneling spectroscopy…

Superconductivity · Physics 2015-06-11 Wei Li , Hao Ding , Pengfei Zhang , Peng Deng , Kai Chang , Ke He , Shuaihua Ji , Lili Wang , Xucun Ma , Jian Wu , Jiang-Ping Hu , Qi-Kun Xue , Xi Chen

One of the most important properties of very recently reported FeSe based superconductors is the robustness of their superconductivity under applied magnetic field. The synthesis and control of superconductivity in FeSe based compounds is…

In this study, we investigate the electronic structure of a spin-triplet superconductor candidate CeRh$_2$As$_2$ using high-resolution angle-resolved photoemission spectroscopy and density functional theory calculations. Notably, Fermi…

We report extensive measurements of quantum oscillations in the normal state of the Fe-based superconductor LaFePO, (Tc ~ 6 K) using low temperature torque magnetometry and transport in high static magnetic fields (45 T). We find that the…

High resolution photoemission measurements have been carried out on non-superconducting LaOFeAs parent compound and various superconducting R(O1-xFx)FeAs (R=La, Ce and Pr) compounds. We found that the parent LaOFeAs compound shows a…

We review a variety of theoretical and experimental results concerning electronic band structure of superconducting materials based on FeSe monolayers. Three type of systems are analyzed: intercalated FeSe systems A_xFe_2Se_{2-x}S_x and…

Superconductivity · Physics 2017-02-20 I. A. Nekrasov , N. S. Pavlov , M. V. Sadovskii , A. A. Slobodchikov

High-temperature superconductivity and a wide variety of exotic superconducting states discovered in FeSe-based materials have been at the frontier of research on condensed matter physics over the past decade. Unique properties originating…

Superconductivity · Physics 2020-10-05 Takasada Shibauchi , Tetsuo Hanaguri , Yuji Matsuda

The electronic structures of the ground state for several different superconducting materials, such as cuprates, conventional 3-dimensional superconductors, doped semiconductors and low-dimensional systems, are quite different and sometimes…

Superconductivity · Physics 2014-12-18 T. Jarlborg

Electronic structures of superconducting Re24Nb5 and Re24Ti5 have been calculated employing the full-potential local-orbital method within the density functional theory. The investigations were focused on the influence of the antisymmetric…

Superconductivity · Physics 2014-08-01 M. J. Winiarski