A High-Throughput Structural and Electrochemical Study of Metallic Glass Formation in Ni-Ti-Al

ACS Comb Sci. 2020 Jul 13;22(7):330-338. doi: 10.1021/acscombsci.9b00215. Epub 2020 Jun 24.

Abstract

On the basis of a set of machine learning predictions of glass formation in the Ni-Ti-Al system, we have undertaken a high-throughput experimental study of that system. We utilized rapid synthesis followed by high-throughput structural and electrochemical characterization. Using this dual-modality approach, we are able to better classify the amorphous portion of the library, which we found to be the portion with a full width at half maximum (fwhm) of >0.42 Å-1 for the first sharp X-ray diffraction peak. Proper phase labeling is important for future machine learning efforts. We demonstrate that the fwhm and corrosion resistance are correlated but that, while chemistry still plays a role in corrosion resistance, a large fwhm, attributed to a glassy phase, is necessary for the highest corrosion resistance.

Keywords: corossion; high-throughput; machine learning; metallic glass; scanning droplet cell.

Publication types

  • Research Support, U.S. Gov't, Non-P.H.S.

MeSH terms

  • Aluminum / chemistry*
  • Electrochemical Techniques*
  • Glass / chemistry
  • High-Throughput Screening Assays*
  • Machine Learning
  • Molecular Structure
  • Nickel / chemistry*
  • Titanium / chemistry*
  • X-Ray Diffraction

Substances

  • titanium nickelide
  • Nickel
  • Aluminum
  • Titanium