Related papers: Electronic, dynamical and superconducting properti…
Determining the types of superconducting order in quantum materials is a challenge, especially when multiple degrees of freedom, such as bands or orbitals, contribute to the fermiology and when superconductivity competes, intertwines, or…
Recent measurements of the anisotropy of the upper critical field Bc2 on MgB2 single crystals have shown a puzzling strong temperature dependence. Here, we present a calculation of the upper critical field based on a detailed modeling of…
Li2Pd3B is known to be superconducting, while the isotypical Li2Pt3B compound is not. Electronic structures of Li2Pd3B and Li2Pt3B have been calculated in order to obtain an insight into this surprising difference, through an analysis of…
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…
Using a 72-atom supercell we report ab initio calculations of the electronic and vibrational densities of states for the bismuth (111) bilayers (bismuthene) with periodic boundary conditions and a vacuum of 5 {\AA}, 10 {\AA} and 20 {\AA}.…
The superconducting order parameter and electron-phonon interaction (EPI) in a MgB$_{2}$ c-axis oriented thin film are investigated by point contacts (PCs). Two superconducting gaps $\Delta_{Small}\approx 2.6$ meV and $\Delta_{Large}\approx…
We present a comparison of electronic structure of MgB2 and TaB2, the two new superconductors, as well as VB2, calculated using full-potential, density- functional-based methods in P6/mmm crystal structure. Our results, described in terms…
The remarkable field dependence of the electronic thermal conductivity observed in MgB_2 can be explained as a consequence of multi-gap superconductivity. A key point is that for moderately clean samples, the mean free path becomes…
Based on the quasiclassical theory, we investigate the vortex state in a two-band superconductor with a small gap on a three dimensional Fermi surface and a large gap on a quasi-two dimensional one, as in MgB_2. The field dependence of…
Single crystals of Rb{0.8}Fe2Se2 are successfully synthesized with the superconducting transition temperatures T_c{onset}= 31 K and T_c{zero}= 28 K. A clear anomaly of resistivity was observed in the normal state at about 150 K, as found in…
We probe the possible double-Weyl state in cubic SrSi2 using optical spectroscopy. The complex optical conductivity was measured in a frequency range from 70 to 22 000 cm-1 at temperatures down to 10 K at ambient pressure. The optical…
The mechanism of high temperature superconductivity in the iron-based superconductors remains an outstanding issue in condensed matter physics. The electronic structure, in particular the Fermi surface topology, is considered to play an…
Fermi surface topology and pairing symmetry are two pivotal characteristics of a superconductor. Superconductivity in one monolayer (1ML) FeSe thin film has attracted great interest recently due to its intriguing interfacial properties and…
We report a comprehensive investigation of the physical properties of LuOs3B2, characterized by an ideal Os-based kagome lattice. Resistivity and magnetization measurements confirm the emergence of type-II bulk superconductivity with a…
The thermal conductivity of the iron-based superconductor FeSe was measured at temperatures down to 50 mK in magnetic fields up to 17 T. In zero magnetic field, the electronic residual linear term in the T = 0 limit, \kappa_0/T, is…
The thermal conductivity kappa of the layered s-wave superconductor NbSe_2 was measured down to T_c/100 throughout the vortex state. With increasing field, we identify two regimes: one with localized states at fields very near H_c1 and one…
Local density calculations of the electronic structure of FeSi, FeSi_{1-x}Al_x and Fe_{1-x}Ir_xSi systems in the B20 structure are presented. Pure FeSi has a semi-conducting gap of 6 mRy at 0 K. Effects of temperature (T) in terms of…
First-principles calculations within the density functional theory (DFT) with GGA-PBE exchange-correlation scheme have been employed to predict the structural, the elastic and the electronic properties of newly discovered lithium silicide…
The electronic energy structures and magnetic properties of layered superconductors $R$Ni$_2$B$_2$C, $R$Fe$_4$Al$_8$ and FeSe are systematically studied, by using the density functional theory (DFT). The calculations allowed us to reveal a…
By means of DFT-based first-principles calculations, we examine two polymorphs of the newly synthesized 1111-like MgFeSeO as possible new superconducting systems. We have found that the polymorph with blocks [MgO], where Mg atoms are placed…