New kagome prototype materials: discovery of KV3Sb5,RbV3Sb5, and CsV3Sb5

Brenden R. Ortiz, Lídia C. Gomes, Jennifer R. Morey, Michal Winiarski, Mitchell Bordelon, John S. Mangum, Iain W. H. Oswald, Jose A. Rodriguez-Rivera, James R. Neilson, Stephen D. Wilson, Elif Ertekin, Tyrel M. McQueen, and Eric S. Toberer
Phys. Rev. Materials 3, 094407 – Published 16 September 2019
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Abstract

In this work, we present our discovery and characterization of a new kagome prototype structure, KV3Sb5. We also present the discovery of the isostructural compounds RbV3Sb5 and CsV3Sb5. All materials exhibit a structurally perfect two-dimensional kagome net of vanadium. Density-functional theory calculations indicate that the materials are metallic, with the Fermi level in close proximity to several Dirac points. Powder and single-crystal syntheses are presented, with postsynthetic treatments shown to deintercalate potassium from single crystals of KV3Sb5. Considering the proximity to Dirac points, deintercalation provides a convenient means to tune the Fermi level. Magnetization measurements indicate that KV3Sb5 exhibits behavior consistent with a the Curie-Weiss model at high temperatures, although the effective moment is low (0.22μB per vanadium ion). An anomaly is observed in both magnetization and heat capacity measurements at 80 K, below which the moment is largely quenched. Elastic neutron scattering measurements find no obvious evidence of long-range or short-range magnetic ordering below 80 K. The possibility of an orbital-ordering event is considered. Single-crystal resistivity measurements show the effect of deintercalation on the electron transport and allow estimation of the Kadowaki-Woods ratio in KV3Sb5. We find that A/γ261μOhm cm molFU2K2J2, suggesting that correlated electron transport may be possible. KV3Sb5 and its cogeners RbV3Sb5 and CsV3Sb5 represent a new family of kagome metals, and our results demonstrate that they deserve further study as potential model systems.

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  • Received 27 February 2019
  • Revised 21 June 2019

DOI:https://doi.org/10.1103/PhysRevMaterials.3.094407

©2019 American Physical Society

Physics Subject Headings (PhySH)

Condensed Matter, Materials & Applied Physics

Authors & Affiliations

Brenden R. Ortiz1,2,*, Lídia C. Gomes3,4, Jennifer R. Morey5, Michal Winiarski5,6, Mitchell Bordelon2, John S. Mangum1, Iain W. H. Oswald7, Jose A. Rodriguez-Rivera8,9, James R. Neilson7, Stephen D. Wilson2, Elif Ertekin3,4, Tyrel M. McQueen5, and Eric S. Toberer1

  • 1Colorado School of Mines, Golden, Colorado 80401, USA
  • 2University of California Santa Barbara, Santa Barbara, California 93106, USA
  • 3University of Illinois at Urbana-Champaign, Urbana, Illinois 61820, USA
  • 4National Center for Supercomputing Applications, Urbana, Illinois 61801, USA
  • 5Johns Hopkins University, Baltimore, Maryland 21218, USA
  • 6Gdansk University of Technology, Gdansk 80-233, Poland
  • 7Colorado State University, Fort Collins, Fort Collins, Colorado 80523, USA
  • 8NIST Center for Neutron Research, Gaithersburg, Maryland 20878, USA
  • 9University of Maryland, College Park, Maryland 20742, USA

  • *Author to whom all correspondence should be addressed: ortiz.brendenr@gmail.com

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Issue

Vol. 3, Iss. 9 — September 2019

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