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DOE OSTI2020

Materials Data on SrAg5 by Materials Project

SrAg5 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Sr is bonded in a distorted hexagonal planar geometry to eighteen Ag atoms. There are six shorter (3.33 Å) and twelve longer (3.72 Å) Sr–Ag bond lengths. There are two inequivalent Ag sites. In the first Ag site, Ag is bonded in a 12-coordinate geometry to three equivalent Sr and six equivalent Ag atoms. All Ag–Ag bond lengths are 2.88 Å. In the second Ag site, Ag is bonded to four equivalent Sr and eight Ag atoms to form a mixture of edge, face, and corner-sharing AgSr4Ag8 cuboctahedra. All Ag–Ag bond lengths are 2.88 Å.

36 MATERIALS SCIENCE↗

DOE OSTI2020

Materials Data on SrAg by Materials Project

SrAg crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent Sr sites. In the first Sr site, Sr is bonded in a 7-coordinate geometry to seven Ag atoms. There are a spread of Sr–Ag bond distances ranging from 3.36–3.49 Å. In the second Sr site, Sr is bonded in a 7-coordinate geometry to seven Ag atoms. There are a spread of Sr–Ag bond distances ranging from 3.36–3.47 Å. There are two inequivalent Ag sites. In the first Ag site, Ag is bonded in a 9-coordinate geometry to seven Sr and two equivalent Ag atoms. Both Ag–Ag bond lengths are 2.96 Å. In the second Ag site, Ag is bonded in a 9-coordinate geometry to seven Sr and two equivalent Ag atoms.

36 MATERIALS SCIENCE↗

DOE OSTI2020

Materials Data on SrAg2 by Materials Project

SrAg2 crystallizes in the orthorhombic Imma space group. The structure is three-dimensional. Sr is bonded in a 12-coordinate geometry to twelve equivalent Ag atoms. There are a spread of Sr–Ag bond distances ranging from 3.36–3.55 Å. Ag is bonded in a 10-coordinate geometry to six equivalent Sr and four equivalent Ag atoms. There are a spread of Ag–Ag bond distances ranging from 2.84–3.06 Å.

36 MATERIALS SCIENCE↗

DOE OSTI2020

Materials Data on Sr3Ag2 by Materials Project

Sr3Ag2 crystallizes in the trigonal R-3 space group. The structure is three-dimensional. there are three inequivalent Sr sites. In the first Sr site, Sr is bonded in a 5-coordinate geometry to five equivalent Ag atoms. There are a spread of Sr–Ag bond distances ranging from 3.36–3.88 Å. In the second Sr site, Sr is bonded in an octahedral geometry to six equivalent Ag atoms. All Sr–Ag bond lengths are 3.43 Å. In the third Sr site, Sr is bonded in a 6-coordinate geometry to six equivalent Ag atoms. There are three shorter (3.28 Å) and three longer (3.41 Å) Sr–Ag bond lengths. Ag is bonded in a 9-coordinate geometry to eight Sr and one Ag atom. The Ag–Ag bond length is 3.04 Å.

36 MATERIALS SCIENCE↗

DOE OSTI2020

Materials Data on Sr7Ag3 by Materials Project

Sr7Ag3 crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. there are three inequivalent Sr sites. In the first Sr site, Sr is bonded in a 3-coordinate geometry to three equivalent Ag atoms. All Sr–Ag bond lengths are 3.27 Å. In the second Sr site, Sr is bonded in a distorted L-shaped geometry to two equivalent Ag atoms. Both Sr–Ag bond lengths are 3.33 Å. In the third Sr site, Sr is bonded in a distorted T-shaped geometry to three equivalent Ag atoms. There are two shorter (3.31 Å) and one longer (3.33 Å) Sr–Ag bond lengths. Ag is bonded in a 6-coordinate geometry to six Sr atoms.

36 MATERIALS SCIENCE↗

DOE OSTI2020

Materials Data on Sr3Ag by Materials Project

Sr3Ag is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Sr is bonded in a distorted square co-planar geometry to four equivalent Ag atoms. All Sr–Ag bond lengths are 3.88 Å. Ag is bonded to twelve equivalent Sr atoms to form a mixture of face and corner-sharing AgSr12 cuboctahedra.

36 MATERIALS SCIENCE↗