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Register a new userMaterials Design for New Superconductors
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Authors
M. R. Norman
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Since the announcement in 2011 of the Materials Genome Initiative by the Obama administration, much attention has been given to the subject of materials design to accelerate the discovery of new materials that could have technological implications. Although having its biggest impact for more applied materials like batteries, there is increasing interest in applying these ideas to predict new superconductors. This is obviously a challenge, given that superconductivity is a many body phenomenon, with whole classes of known superconductors lacking a quantitative theory. Given this caveat, various efforts to formulate materials design principles for superconductors are reviewed here, with a focus on surveying the periodic table in an attempt to identify cuprate analogues.
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By paying special attention to the fact that the doped holes induce deformation of CuO6 octahedrons (or CuO5 pyramids) in cuprate superconductors, we develop a non-rigid band theory treating doping-induced alterations of energy-band structures in copper oxide superconductors. Thanks to this theory, we obtain a complete picture of the doping-induced alteration in the electronic structure of La2CuO4, from the spin-disordered insulating phase to the metallic phase. We conclude that the Fermi surface structure of this cuprate in the underdoped region consists of Fermi pockets in the antinodal region and Fermi arcs in the nodal region, and thus that the origin of a so-called pseudogap is closely related to the existence of Fermi pockets. Moreover, we show that the carriers on the Fermi pockets contribute to the phonon mechanism in d-wave superconductivity. Finally, we discuss how one will be able to find higher Tc materials, based on the conclusions mentioned above.
Motivated by recent progress in epitaxial growth of proximity structures of s-wave superconductors (S) and spin-active materials (M), we show that the periodic structure of S and M can behave effectively as a superconductor with pairs of point nodes, near which the low energy excitations are Weyl fermions. A simple toy model, where M is described by a Kronig-Penney potential with both spin-orbit coupling and exchange field, is proposed and solved to obtain the phase diagram of the nodal structure, the spin texture of the Weyl fermions, as well as the zero energy surface states in the form of open Fermi lines (Fermi arcs). Going beyond the simple model, a lattice model with alternating layers of S and magnetic $Z_2$ topological insulators (M) is solved. The calculated spectrum confirms previous prediction of Weyl nodes based on tunneling Hamiltonian of Dirac electrons. Our results provide further evidence that periodic structures of S and M are well suited for engineering gapless topological superconductors.
Hydrogen-based superconductors provide a route to the long-sought goal of room-temperature superconductivity, but the high pressures required to metallize these materials limit their immediate application. For example, carbonaceous sulfur hydride, the first room-temperature superconductor, can reach a critical temperature (Tc) of 288 K only at the extreme pressure of 267 GPa. The next recognized challenge is the realization of room-temperature superconductivity at significantly lower pressures. Here, we propose a strategy for the rational design of high-temperature superconductors at low pressures by alloying small-radius elements and hydrogen to form ternary hydride superconductors with alloy backbones. We identify a hitherto unknown fluorite-type backbone in compositions of the form AXH8, which exhibit high temperature superconductivity at moderate pressures. The Fm-3m phase of LaBeH8, with a fluorite-type H-Be alloy backbone, is predicted to be metastable and superconducting with a Tc ~ 191 K at 50 GPa; a substantially lower pressure than that required by the geometrically similar clathrate hydride LaH10 (170 GPa). Our approach paves the way for finding high-Tc ternary hydride superconductors at conditions close to ambient pressures.
High-temperature superconductivity has been discovered in La2-xBaxCuO4 [1], a compound that derives from the undoped La2CuO4 crystallizing in the perovskite T-structure. In this structure oxygen octahedra surround the copper ions. It is common knowledge that charge carriers induced by doping in such an undoped antiferromagnetic Mott-insulator lead to high-temperature superconductivity [2- 4]. The undoped material La2CuO4 is also the basis of the electron-doped cuprate superconductors [5] of the form La2-xCexCuO4+y [6,7] which however crystallize in the so called T-prime-structure, i.e. without apical oxygen above or below the copper ions of the CuO2-plane. It is well known that for La2-xCexCuO4+y the undoped T-prime-structure parent compound cannot be prepared due to the structural phase transition back into the T-structure occuring around x ~ 0.05. Here, we report that if La is substituted by RE = Y, Lu, Sm, Eu, Gd, or Tb, which have smaller ionic radii but have the same valence as La, nominally undoped La2-xRExCuO4 can be synthesized by molecular beam epitaxy in the T-prime-structure. The second important result is that all these new T-prime-compounds are superconductors with fairly high critical temperatures up to 21 K. For this new class of cuprates La2-xRExCuO4, which forms the T-prime-parent compounds of the La-based electron doped cuprates, we have not been able to obtain the Mott-insulating ground state for small x before the structural phase transition into the T-structure takes place.
From our powder x ray diffraction pattern, electrical transport and magnetic studies we report the effect of isovalent Se substitution at S sites in the newly discovered systems EuSr2Bi2S4F4 and Eu2SrBi2S4F4. We have synthesized two new variants of 3244 type superconductor with Eu replaced by Sr which is reported elsewhere [Z. Haque et. al.]. We observe superconductivity at Tc 2.9 K (resistivity) and 2.3 K (susceptibility) in EuSr2Bi2S4-xSexF4 series for x = 2. In the other series Eu2SrBi2S4-xSexF4, two materials (x= 1.5; Tc = 2.6 K and x = 2; Tc = 2.75 K) exhibit superconductivity.
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