ScAuIn – a new representative of the RAuIn series

Publikation: Beitrag in FachzeitschriftForschungsartikelBeigetragenBegutachtung

Beitragende

  • V. V. Romaka - , Leibniz Institute for Solid State and Materials Research Dresden (Autor:in)
  • M. L. Amigó - , Leibniz Institute for Solid State and Materials Research Dresden (Autor:in)
  • D. Franco - , Max Planck Institute for Chemical Physics of Solids, Universidad Nacional de Cuyo (Autor:in)
  • L. T. Corredor - , Leibniz Institute for Solid State and Materials Research Dresden (Autor:in)
  • S. Wurmehl - , Leibniz Institute for Solid State and Materials Research Dresden (Autor:in)
  • B. Büchner - , Professur für Experimentelle Festkörperphysik (gB/IFW), Leibniz Institute for Solid State and Materials Research Dresden (Autor:in)
  • S. Seiro - , Leibniz Institute for Solid State and Materials Research Dresden (Autor:in)

Abstract

A new representative of the RAuIn series was discovered in the Sc-Au-In system. ScAuIn crystallizes in the hexagonal HfRhSn-type structure (space group P-62c) with a ​= ​0.75667(2), c ​= ​0.71873(2) nm). Magnetization measurements revealed that ScAuIn is a Pauli paramagnet with magnetic susceptibility of ∼6 ​× ​10−5 emu/mol. The Sommerfeld coefficient γ of 2.8 ​mJ ​K−2 ​mol−1 derived from the specific heat measurements is comparable with those obtained from the modeled density of states at the Fermi level N(EF). Ab initio calculations predict metallic conductivity and show strong chemical bonding within the [InAu] sublattice. The structural stability of the RAuIn with ZrNiAl and HfRhSn structure types is discussed based on crystal chemistry analysis and DFT modeling.

Details

OriginalspracheEnglisch
Aufsatznummer123416
FachzeitschriftJournal of solid state chemistry
Jahrgang314
PublikationsstatusVeröffentlicht - Okt. 2022
Peer-Review-StatusJa