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Sluggish atomic dynamics in a Y-Sc-Co-Al high entropy bulk metallic glass

We present how 20 at% Sc addition affects the atomic packing and dynamics in a Y-Co-Al metallic glass (MG) and find that it greatly suppresses the dynamics of Co atoms by reducing the atomic packing difference in their surroundings. The Co atoms tending to be mobile or static depend on their nearest neighbors, i.e., possessing more Y/Y+Sc atoms but fewer Co atoms or vice versa. The X-ray absorption fine structure results confirm that Sc addition mainly changes the local environment around Co atoms, forming more Co-Co and Co-Sc pairs but significantly fewer Co-Y pairs than in the ternary counterpart, which can seriously slow the atomic dynamics and stabilize the competing phases. Our findings shed new light on the understanding of strong glass forming ability of the Sc-added Y-based high entropy MG from its local structure and dynamics and will be helpful in developing new bulk MGs.

36 MATERIALS SCIENCE↗

Materials Data on ScCo by Materials Project

ScCo1 is Tetraauricupride structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Sc is bonded in a body-centered cubic geometry to eight equivalent Co atoms. All Sc–Co bond lengths are 2.70 Å. Co is bonded in a body-centered cubic geometry to eight equivalent Sc atoms.

36 MATERIALS SCIENCE↗

Materials Data on ScCo2 by Materials Project

ScCo2 is Cubic Laves structured and crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Sc is bonded in a 12-coordinate geometry to twelve equivalent Co atoms. All Sc–Co bond lengths are 2.86 Å. Co is bonded to six equivalent Sc and six equivalent Co atoms to form a mixture of corner, edge, and face-sharing CoSc6Co6 cuboctahedra. All Co–Co bond lengths are 2.44 Å.

36 MATERIALS SCIENCE↗

Materials Data on Sc3Co by Materials Project

Sc3Co is Cementite-like structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are four inequivalent Sc sites. In the first Sc site, Sc is bonded in a bent 150 degrees geometry to two Co atoms. There are one shorter (2.48 Å) and one longer (2.58 Å) Sc–Co bond lengths. In the second Sc site, Sc is bonded in a distorted L-shaped geometry to two Co atoms. Both Sc–Co bond lengths are 2.58 Å. In the third Sc site, Sc is bonded in a 2-coordinate geometry to three Co atoms. There are a spread of Sc–Co bond distances ranging from 2.66–3.04 Å. In the fourth Sc site, Sc is bonded in a 3-coordinate geometry to three Co atoms. There are a spread of Sc–Co bond distances ranging from 2.56–2.94 Å. There are two inequivalent Co sites. In the first Co site, Co is bonded in a 8-coordinate geometry to eight Sc atoms. In the second Co site, Co is bonded in a 6-coordinate geometry to eight Sc atoms.

36 MATERIALS SCIENCE↗

Materials Data on Sc2Co by Materials Project

CoSc2 crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. Sc is bonded in a 4-coordinate geometry to four equivalent Co atoms. All Sc–Co bond lengths are 2.71 Å. Co is bonded in a 10-coordinate geometry to eight equivalent Sc atoms.

36 MATERIALS SCIENCE↗