4.1 Article Data Paper

Data set for diffusion coefficients and relative creep rate ratios of 26 dilute Ni-X alloy systems from first-principles calculations

Journal

DATA IN BRIEF
Volume 20, Issue -, Pages 1537-1551

Publisher

ELSEVIER SCIENCE BV
DOI: 10.1016/j.dib.2018.08.144

Keywords

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Funding

  1. Office of Naval Research (ONR) [N0014-07-1-0638, N00014-17-1-2567]
  2. National Natural Science Foundation of China [51429101]
  3. Materials Simulation Center
  4. Research Computing and Cyber infrastructure unit at the Pennsylvania State University
  5. Office of Science of the U.S. DOE [DE-AC02-05CH11231]
  6. National Science Foundation [ACI-1053575. 51429101]

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The development of future generations of Ni-base superalloys will depend on a systematic understanding of how each alloying element affects the fundamental properties of Ni-base superalloys, particularly with respect to their creep behavior. First, this article presents the temperature-dependent data of all factors entering into dilute impurity diffusion for 26 Ni-X alloy systems, including atomic jump frequencies, thermodynamic parameters, and diffusivity plots. Second, this article presents the data used to calculate the relative creep rate ratios showing the effect of each of the 26 alloying elements, X, on the dilute Ni-X alloy. The dataset refers to A comprehensive first-principles study of solute elements in dilute Ni alloys: Diffusion coefficients and their implications to tailor creep rate by Hargather et al. [1]. (C) 2018 The Authors. Published by Elsevier Inc. This is an open access article under the CC BY-NC-ND license.

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