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Data from "First-principles thermal compatibility between Ru-based Re-substitute alloys and Ir coatings"

Full Metadata

Overview

Year:
2019
Contributor:
Sun, Ruoshi (Creator)
Asta, Mark (Creator)
van de Walle, Axel (Creator)
Subject:
thermal expansion
density functional theory
DOI
https://doi.org/10.7910/DVN/JE61ZZ

Files

Description

Abstract:
Data from Sun, R., Asta, M., and van de Walle, A. (2019). First-principles thermal compatibility between Ru-based Re-substitute alloys and Ir coatings. Computational Materials Science, 170.doi: 10.1016/j.commatsci.2019.109199. This dataset contains thermal expansion calculations of pure Ir, Re, Ru, and binary/ternary Ru alloys with special quasi-random structures.
Notes:
The authors acknowledge support from the Office of Naval Research through program number N00014-16-1-3124. Computational resources were provided by the Center for Computation and Visualization at Brown University and the Extreme Science and Engineering Discovery Environment (XSEDE) Stampede2 at the Texas Advanced Computing Center through allocation TG-DMR050013N, which is supported by National Science Foundation Grant No. ACI-1548562.

Access Conditions

Use and Reproduction
This work is licensed under a Creative Commons Attribution 4.0 International License

Citation

Sun, Ruoshi, Asta, Mark, and van de Walle, Axel, "Data from 'First-principles thermal compatibility between Ru-based Re-substitute alloys and Ir coatings'" (2019). Brown University Open Data Collection. Brown Digital Repository. Brown University Library. https://doi.org/10.7910/DVN/JE61ZZ

Relations

Has Parts:

  • Child thumbnail
    Ir: Thermal expansion of Ir, Re, Ru, and Ru alloys
    • Type: Archive
    • Order: 1
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  • Child thumbnail
    Re: Thermal expansion of Ir, Re, Ru, and Ru alloys
    • Type: Archive
    • Order: 2
    • View
  • Child thumbnail
    Ru: Thermal expansion of Ir, Re, Ru, and Ru alloys
    • Type: Archive
    • Order: 3
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  • Child thumbnail
    Ru3Mo: Thermal expansion of Ir, Re, Ru, and Ru alloys
    • Type: Archive
    • Order: 4
    • View
  • Child thumbnail
    Ru3W: Thermal expansion of Ir, Re, Ru, and Ru alloys
    • Type: Archive
    • Order: 5
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  • Child thumbnail
    Ru3Ta: Thermal expansion of Ir, Re, Ru, and Ru alloys
    • Type: Archive
    • Order: 6
    • View
  • Child thumbnail
    Ru6MoTa: Thermal expansion of Ir, Re, Ru, and Ru alloys
    • Type: Archive
    • Order: 7
    • View
  • Child thumbnail
    Ru6MoW: Thermal expansion of Ir, Re, Ru, and Ru alloys
    • Type: Archive
    • Order: 8
    • View
  • Child thumbnail
    Ru6TaW: Thermal expansion of Ir, Re, Ru, and Ru alloys
    • Type: Archive
    • Order: 9
    • View
  • Child thumbnail
    Ru7Mo: Thermal expansion of Ir, Re, Ru, and Ru alloys
    • Type: Archive
    • Order: 10
    • View
  • Child thumbnail
    Ru7Ta: Thermal expansion of Ir, Re, Ru, and Ru alloys
    • Type: Archive
    • Order: 11
    • View
  • Child thumbnail
    Ru7W: Thermal expansion of Ir, Re, Ru, and Ru alloys
    • Type: Archive
    • Order: 12
    • View
  • Child thumbnail
    First-principles thermal compatibility between Ru-based Re-substitute alloys and Ir coatings
    • Type: Archive
    • Order: 13
    • View

Collection:

  • Brown University Open … Thumbnail

    Brown University Open Data Collection

    This collection contains open and publicly-funded data sets created by Brown University faculty and student researchers. Increasingly, publishers, and funders are requiring that protocols, data sets, metadata, and code underlying published research be retained and preserved, their locations cited within …
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