High-TC Superconductivity in Hydrogen Clathrates Mediated by Coulomb Interactions Between Hydrogen and Central-Atom Electrons

The uniquely characteristic macrostructures of binary hydrogen-clathrate compounds M H n formed at high pressure, a cage of hydrogens surrounding a central-atom host, is theoretically predicted in various studies to include structurally stable phonon-mediated superconductors. High superconductive tr...

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Bibliographic Details
Published inJournal of superconductivity and novel magnetism Vol. 33; no. 10; pp. 2945 - 2961
Main Authors Harshman, Dale R., Fiory, Anthony T.
Format Journal Article
LanguageEnglish
Published New York Springer US 01.10.2020
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Summary:The uniquely characteristic macrostructures of binary hydrogen-clathrate compounds M H n formed at high pressure, a cage of hydrogens surrounding a central-atom host, is theoretically predicted in various studies to include structurally stable phonon-mediated superconductors. High superconductive transition temperatures T C have thus far been measured for syntheses with M  = La, Y, and Th. In compressed LaH 10 , independent studies report T C of 250 K and over 260 K, a maximum in T C with pressure P , and normal-state resistance scaling with temperature (suggesting unconventional pairing). According to reported band structure calculations of Fm 3 ¯ m -phase LaH 10 , the La is anionic, with the chemical valence electrons appearing evenly split between La and H 10 . Thus, compressed LaH 10 contains the combination of structure, charge separation, and optimal balanced allocation of valence electrons for supporting unconventional high- T C superconductivity mediated by Coulomb interactions between electronic charges associated with La and H 10 . A general expression for the optimal superconducting transition temperature for M H n clathrates is derived as T C0  =  k B −1 Λ[(n +  v )/2 A ] 1/2 e 2 /ζ, where Λ is a universal constant, (n +  v ) is the chemical valence sum per formula unit, taking unity for H and v for atom M , A is the surface area of the H-polyhedron cage, and ζ is the mean distance between the M site and the centroids of the polyhedron faces. Applied to Fm 3 ¯ m LaH 10 , T C0 values of  249.8(1.3) K and 260.7(2.0) K are found for the two experiments. Associated attributes of charge allocation, structure, effective Coulomb potential, and H-D isotope effect in T C of Fm 3 ¯ m LaH 10 and Im 3 ¯ m H 3 S are discussed, along with a generalized prospective for Coulomb-mediated superconductivity in M H n .
ISSN:1557-1939
1557-1947
DOI:10.1007/s10948-020-05557-4