Article Element-selective structural visualization for the oxygen-induced surface of Nb⁡(110)

Yuuki Yasui ; Katsuyuki Matsunaga ; Keisuke Sagisaka SAMURAI ORCID (National Institute for Materials Science) ; Yoshiaki Sugimoto

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Yuuki Yasui, Katsuyuki Matsunaga, Keisuke Sagisaka, Yoshiaki Sugimoto. Element-selective structural visualization for the oxygen-induced surface of Nb⁡(110). Physical Review B. 2024, 109 (), 195417. https://doi.org/10.1103/physrevb.109.195417
SAMURAI

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(abstract)

The highest superconducting transition temperature in Nb among elemental materials facilitates applications of superconducting junctions. Nonetheless, its surface forms self-organized oxide structures, which hinders the preparation of well-defined interfaces. We investigated the atomic structure of oxygen-induced Nb(1 1 0) surfaces, aiming to define the substrates for such interfaces. The atomic force microscopy and scanning tunneling microscopy measurements visualized two rows of apparently low-lying Nb and three rows of O between Nb chains. An optimized model structure is proposed based on density-functional theory calculations. Analysis of the Bader charge and the density of states clarified how the atoms appear in the microscopies.

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Keyword: Nb(110), AFM, STM, DFT

Date published: 2024-05-08

Publisher: American Physical Society (APS)

Journal:

  • Physical Review B (ISSN: 24699969) vol. 109 195417

Funding:

  • Japan Society for the Promotion of Science 22H04496
  • Japan Society for the Promotion of Science 20H05849
  • Japan Society for the Promotion of Science 21K18867
  • Japan Society for the Promotion of Science 22H05448
  • Japan Society for the Promotion of Science 22H01950
  • Japan Science and Technology Agency JPMJFR203J
  • Asahi Glass Foundation
  • Murata Science Foundation

Manuscript type: Publisher's version (Version of record)

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First published URL: https://doi.org/10.1103/physrevb.109.195417

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Updated at: 2024-05-29 08:30:07 +0900

Published on MDR: 2024-05-29 08:30:08 +0900

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