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Materials Data on Er2Al4CoGe2 by Materials Project

Er2CoAl4Ge2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Er is bonded in a 5-coordinate geometry to four equivalent Al and five equivalent Ge atoms. All Er–Al bond lengths are 3.09 Å. All Er–Ge bond lengths are 2.93 Å. Co is bonded in a body-centered cubic geometry to eight Al atoms. All Co–Al bond lengths are 2.42 Å. There are three inequivalent Al sites. In the first Al site, Al is bonded in a 4-coordinate geometry to two equivalent Er, two equivalent Co, five Al, and two equivalent Ge atoms. There are one shorter (2.57 Å) and four longer (2.91 Å) Al–Al bond lengths. Both Al–Ge bond lengths are 2.80 Å. In the second Al site, Al is bonded in a 4-coordinate geometry to two equivalent Er, two equivalent Co, five Al, and two equivalent Ge atoms. Both Al–Er bond lengths are 3.09 Å. Both Al–Co bond lengths are 2.42 Å. There are one shorter (2.57 Å) and four longer (2.91 Å) Al–Al bond lengths. Both Al–Ge bond lengths are 2.80 Å. In the third Al site, Al is bonded in a 4-coordinate geometry to two equivalent Er, two equivalent Co, five Al, and two equivalent Ge atoms. Both Al–Er bond lengths are 3.09 Å. The Al–Al bond length is 2.57 Å. Both Al–Ge bond lengths are 2.80 Å. Ge is bonded in a 9-coordinate geometry to five equivalent Er and four Al atoms.

36 MATERIALS SCIENCE↗

Materials Data on Er3Al3CoGe2 by Materials Project

Er3CoAl3Ge2 crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Er is bonded in a 5-coordinate geometry to one Co, six equivalent Al, and four equivalent Ge atoms. The Er–Co bond length is 2.78 Å. There are four shorter (3.18 Å) and two longer (3.29 Å) Er–Al bond lengths. All Er–Ge bond lengths are 2.95 Å. Co is bonded in a distorted q6 geometry to three equivalent Er and six equivalent Al atoms. All Co–Al bond lengths are 2.60 Å. Al is bonded to six equivalent Er, two equivalent Co, two equivalent Al, and two equivalent Ge atoms to form a mixture of distorted corner, edge, and face-sharing AlEr6Al2Co2Ge2 tetrahedra. Both Al–Al bond lengths are 2.71 Å. Both Al–Ge bond lengths are 2.74 Å. Ge is bonded in a 9-coordinate geometry to six equivalent Er and three equivalent Al atoms.

36 MATERIALS SCIENCE↗