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We discuss the electronic structure, lattice dynamics and electron-phonon interaction of newly discovered superconductor LaO$_{0.5}$F$_{0.5}$BiS$_{2}$ using density functional based calculations. A strong Fermi surface nesting at…

Superconductivity · Physics 2015-03-20 Xiangang Wan , Hang-Chen Ding , Sergey Y. Savrasov , Chun-Gang Duan

The electronic structures of the ferromagnetic superconductors $\mathrm{UGe}_2$ and $\mathrm{UCoGe}$ in the paramagnetic phase were studied by angle-resolved photoelectron spectroscopy using soft X-rays ($h\nu =400-500$). The quasi-particle…

Fe-based superconductors exhibit a diverse interplay between charge, orbital, and magnetic ordering1-4. Variations in atomic geometry affect electron hopping between Fe atoms5,6 and the Fermi surface topology, influencing magnetic…

A new iron-oxychalcogenide (CaO)(FeSe) was obtained which crystallizes in the orthorhombic space group Pnma (No. 62) with a = 5.9180(12) {\AA}, b = 3.8802(8) {\AA}, c = 13.193(3) {\AA}. The unique structure of (CaO)(FeSe) is built up of a…

Some important aspects of the electronic structure of the iron oxypnictides depend very sensitively on small changes in interatomic distances and bond angles within the iron-pnictogen subunit. Using first-principles full-potential…

Superconductivity · Physics 2009-11-13 Veronica Vildosola , Leonid Pourovskii , Ryotaro Arita , Silke Biermann , Antoine Georges

High resolution angle-resolved photoemission measurements have been carried out to study the electronic structure and superconducting gap of the (Tl$_{0.58}$Rb$_{0.42}$)Fe$_{1.72}$Se$_2$ superconductor with a T$_c$=32 K. The Fermi surface…

The recently discovered high-T$_c$ superconductor Ca$_{1-x}$La$_{x}$FeAs$_{2}$ is a unique compound not only because of its low symmetry crystal structure, but also because of its electronic structure which hosts Dirac-like metallic bands…

Strongly Correlated Electrons · Physics 2017-01-25 Chang-Jong Kang , Turan Birol , Gabriel Kotliar

We investigate electronic structure of the new iron chalcogenide high temperature superconductor K{1-x}Fe{2-y}Se2 (hole doped case with x=0.24, y=0.28) in the normal phase using the novel LDA'+DMFT computational approach. We show that this…

Strongly Correlated Electrons · Physics 2013-03-27 I. A. Nekrasov , N. S. Pavlov , M. V. Sadovskii

Crystal structures and microstructural features, such as structural phase transitions, defect structures, chemical and structural inhomogeneities, are known to have profound effects on the physical properties of superconducting materials.…

Superconductivity · Physics 2013-07-22 Wang Zhen , Cai Yao , Yang Huai-Xin , Tian Huan-Fang , Wang Zhi-Wei , Ma Chao , Chen Zhen , Li Jian-Qi

We have performed x-ray photoemission spectroscopy on the system of noncentrosymmetric superconductor, Li$_2$(Pd$_x$Pt$_{1-x}$3)B. For Li$_2$Pt$_3$B, we found 2 major peaks with 2 other weak components, and the band calculations were in…

Electronic structures of three superconducting rare-earth iron silicides (Lu;Y;Sc)2Fe3Si5 and non-superconducting Lu2Ru3Si5, adopting a tetragonal crystal structure (P4/mnc), have been calculated employing the full-potential local-orbital…

Superconductivity · Physics 2014-09-08 M. Samsel-Czekała , M. J. Winiarski

Being homologue to the new, Fe-based type of high-temperature superconductors, CeFePO exhibits magnetism, Kondo and heavy-fermion phenomena. We experimentally studied the electronic structure of CeFePO by means of angle-resolved…

FeSe-derived superconductors show some unique behaviors relative to iron-pnictide superconductors, which are very helpful to understand the mechanism of superconductivity in high-Tc iron-based superconductors. The low-energy electronic…

Superconductivity · Physics 2014-12-17 X. F. Lu , N. Z. Wang , H. Wu , Y. P. Wu , D. Zhao , X. Z. Zeng , X. G. Luo , T. Wu , W. Bao , G. H. Zhang , F. Q. Huang , Q. Z. Huang , X. H. Chen

We report the electronic structure and related properties of the superconductor Ta2PdSe5 as determined from density functional calculations. The Fermi surface has two disconnected sheets, both derived from bands of primarily chalcogenide p…

Superconductivity · Physics 2015-04-28 David J. Singh

The symmetry and structure of the superconducting gap in the Fe-based superconductors are the central issue for understanding these novel materials. So far the experimental data and theoretical models have been highly controversial. Some…

Superconductivity · Physics 2011-09-13 B. Zeng , G. Mu , H. Q. Luo , T. Xiang , H. Yang , L. Shan , C. Ren , I. I. Mazin , P. C. Dai , H. -H. Wen

The isovalent-substituted iron-pnictide superconductor SrFe$_{2}$(As$_{1-x}$P$_{x}$)$_{2}$ ($x$=0.35) has a slightly higher optimum critical temperature than the similar system BaFe$_{2}$(As$_{1-x}$P$_{x}$)$_{2}$, and its parent compound…

We provide a band structure with low-energy properties consistent with recent photoemission and quantum oscillations measurements on FeSe, assuming mean-field like s and/or d-wave orbital ordering at the structural transition. We show how…

Superconductivity · Physics 2015-07-27 Shantanu Mukherjee , A. Kreisel , P. J. Hirschfeld , Brian M. Andersen

The superconducting order parameter of the first heavy-fermion superconductor CeCu2Si2 is currently under debate. A key ingredient to understand its superconductivity and physical properties is the quasiparticle dispersion and Fermi…

We performed a combined angle-resolved photoemission spectroscopy and scanning tunneling microscopy study of the electronic structure of electron-doped Ca$_{0.83}$La$_{0.17}$Fe$_2$As$_2$. A surface reconstruction associated with the…

Superconductivity · Physics 2013-01-08 Y. -B. Huang , P. Richard , J. -H. Wang , X. -P. Wang , X. Shi , N. Xu , Z. Wu , A. Li , J. -X. Yin , T. Qian , B. Lv , C. W. Chu , S. H. Pan , M. Shi , H. Ding

The discovery of high-temperature (Tc) superconductivity in monolayer FeSe on SrTiO3 raised a fundamental question whether high Tc is commonly realized in monolayer iron-based superconductors. Tetragonal FeS is a key material to resolve…

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