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Correlation of the fragility of metallic liquids with the high temperature structure, volume, and cohesive energy.

A K GangopadhyayChristopher E PuebloR DaiM L JohnsonR AshcraftDaniel C Van HoesenM SellersK F Kelton
Published in: The Journal of chemical physics (2018)
The thermal expansion coefficients, structure factors, and viscosities of twenty-five equilibrium and supercooled metallic liquids have been measured using an electrostatic levitation (ESL) facility. The structure factor was measured at the Advanced Photon Source, Argonne, using the ESL. A clear connection between liquid fragility and structural and volumetric changes at high temperatures is established; the observed changes are larger for the more fragile liquids. It is also demonstrated that the fragility of metallic liquids is determined to a large extent by the cohesive energy and is, therefore, predictable. These results are expected to provide useful guidance in the future design of metallic glasses.
Keyphrases
  • high temperature
  • molecular dynamics simulations
  • molecular dynamics
  • ionic liquid