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DOE OSTI2020

Materials Data on Dy5Ru2 by Materials Project

Dy5Ru2 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. there are three inequivalent Dy sites. In the first Dy site, Dy is bonded in a 2-coordinate geometry to three equivalent Ru atoms. There are a spread of Dy–Ru bond distances ranging from 2.74–3.40 Å. In the second Dy site, Dy is bonded to four equivalent Ru atoms to form distorted edge-sharing DyRu4 tetrahedra. There are two shorter (2.89 Å) and two longer (2.95 Å) Dy–Ru bond lengths. In the third Dy site, Dy is bonded in a 3-coordinate geometry to three equivalent Ru atoms. There are a spread of Dy–Ru bond distances ranging from 2.83–3.04 Å. Ru is bonded in a 7-coordinate geometry to eight Dy atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Dy3Ru by Materials Project

Dy3Ru is Cementite structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent Dy sites. In the first Dy site, Dy is bonded in a 3-coordinate geometry to three equivalent Ru atoms. There are a spread of Dy–Ru bond distances ranging from 2.85–3.22 Å. In the second Dy site, Dy is bonded in a distorted bent 150 degrees geometry to two equivalent Ru atoms. There are one shorter (2.75 Å) and one longer (2.79 Å) Dy–Ru bond lengths. Ru is bonded in a 6-coordinate geometry to eight Dy atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on DyRu3 by Materials Project

DyRu3 is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Dy is bonded to twelve equivalent Ru atoms to form a mixture of corner and face-sharing DyRu12 cuboctahedra. All Dy–Ru bond lengths are 2.86 Å. Ru is bonded in a distorted square co-planar geometry to four equivalent Dy atoms.

36 MATERIALS SCIENCE↗