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Materials Data on ZrPt by Materials Project

ZrPt is Tetraauricupride structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Zr2+ is bonded in a body-centered cubic geometry to eight equivalent Pt2- atoms. All Zr–Pt bond lengths are 2.91 Å. Pt2- is bonded in a body-centered cubic geometry to eight equivalent Zr2+ atoms.

36 MATERIALS SCIENCE↗

Materials Data on ZrPt3 by Materials Project

Pt3Zr is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Zr2+ is bonded to twelve equivalent Pt+0.67- atoms to form a mixture of face and corner-sharing ZrPt12 cuboctahedra. All Zr–Pt bond lengths are 2.87 Å. Pt+0.67- is bonded in a distorted square co-planar geometry to four equivalent Zr2+ atoms.

36 MATERIALS SCIENCE↗

Materials Data on Zr9Pt11 by Materials Project

Zr9Pt11 crystallizes in the tetragonal I4/m space group. The structure is three-dimensional. there are three inequivalent Zr+2.44+ sites. In the first Zr+2.44+ site, Zr+2.44+ is bonded in a 9-coordinate geometry to nine Pt2- atoms. There are a spread of Zr–Pt bond distances ranging from 2.79–3.22 Å. In the second Zr+2.44+ site, Zr+2.44+ is bonded in a body-centered cubic geometry to eight Pt2- atoms. There are a spread of Zr–Pt bond distances ranging from 2.76–2.85 Å. In the third Zr+2.44+ site, Zr+2.44+ is bonded in a 10-coordinate geometry to ten Pt2- atoms. There are eight shorter (3.03 Å) and two longer (3.43 Å) Zr–Pt bond lengths. There are three inequivalent Pt2- sites. In the first Pt2- site, Pt2- is bonded in a 7-coordinate geometry to seven Zr+2.44+ atoms. In the second Pt2- site, Pt2- is bonded in a 8-coordinate geometry to eight Zr+2.44+ atoms. In the third Pt2- site, Pt2- is bonded in a distorted square co-planar geometry to six Zr+2.44+ atoms.

36 MATERIALS SCIENCE↗

Materials Data on ZrPt8 by Materials Project

Pt8Zr crystallizes in the tetragonal I4/mmm space group. The structure is one-dimensional and consists of two Pt8Zr ribbons oriented in the (0, 0, 1) direction. Zr4+ is bonded to twelve Pt+0.50- atoms to form face-sharing ZrPt12 cuboctahedra. All Zr–Pt bond lengths are 2.83 Å. There are two inequivalent Pt+0.50- sites. In the first Pt+0.50- site, Pt+0.50- is bonded in a distorted single-bond geometry to one Zr4+ atom. In the second Pt+0.50- site, Pt+0.50- is bonded in a distorted L-shaped geometry to two equivalent Zr4+ atoms.

36 MATERIALS SCIENCE↗

Materials Data on Zr7Pt10 by Materials Project

Zr7Pt10 crystallizes in the orthorhombic Cmce space group. The structure is three-dimensional. there are four inequivalent Zr+2.86+ sites. In the first Zr+2.86+ site, Zr+2.86+ is bonded in a 10-coordinate geometry to ten Pt2- atoms. There are a spread of Zr–Pt bond distances ranging from 2.88–2.98 Å. In the second Zr+2.86+ site, Zr+2.86+ is bonded in a body-centered cubic geometry to eight Pt2- atoms. There are four shorter (2.81 Å) and four longer (2.82 Å) Zr–Pt bond lengths. In the third Zr+2.86+ site, Zr+2.86+ is bonded in a distorted body-centered cubic geometry to eight Pt2- atoms. There are a spread of Zr–Pt bond distances ranging from 2.79–2.85 Å. In the fourth Zr+2.86+ site, Zr+2.86+ is bonded in a 7-coordinate geometry to seven Pt2- atoms. There are a spread of Zr–Pt bond distances ranging from 2.83–2.92 Å. There are three inequivalent Pt2- sites. In the first Pt2- site, Pt2- is bonded in a 6-coordinate geometry to six Zr+2.86+ atoms. In the second Pt2- site, Pt2- is bonded in a 1-coordinate geometry to five Zr+2.86+ atoms. In the third Pt2- site, Pt2- is bonded in a 6-coordinate geometry to six Zr+2.86+ atoms.

36 MATERIALS SCIENCE↗

Materials Data on ZrPt by Materials Project

ZrPt crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Zr2+ is bonded in a 7-coordinate geometry to seven equivalent Pt2- atoms. There are a spread of Zr–Pt bond distances ranging from 2.79–2.98 Å. Pt2- is bonded in a 7-coordinate geometry to seven equivalent Zr2+ atoms.

36 MATERIALS SCIENCE↗

Materials Data on Zr2Pt by Materials Project

Zr2Pt crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. there are two inequivalent Zr sites. In the first Zr site, Zr is bonded in a 6-coordinate geometry to six equivalent Pt atoms. All Zr–Pt bond lengths are 2.83 Å. In the second Zr site, Zr is bonded in a 2-coordinate geometry to four equivalent Pt atoms. There are two shorter (2.80 Å) and two longer (3.22 Å) Zr–Pt bond lengths. Pt is bonded in a 9-coordinate geometry to nine Zr atoms.

36 MATERIALS SCIENCE↗

Materials Data on ZrPt3 by Materials Project

Pt3Zr is Uranium Silicide-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are two inequivalent Zr2+ sites. In the first Zr2+ site, Zr2+ is bonded to twelve Pt+0.67- atoms to form a mixture of face and corner-sharing ZrPt12 cuboctahedra. There are six shorter (2.87 Å) and six longer (2.89 Å) Zr–Pt bond lengths. In the second Zr2+ site, Zr2+ is bonded to twelve Pt+0.67- atoms to form a mixture of face and corner-sharing ZrPt12 cuboctahedra. All Zr–Pt bond lengths are 2.87 Å. There are two inequivalent Pt+0.67- sites. In the first Pt+0.67- site, Pt+0.67- is bonded in a distorted see-saw-like geometry to four Zr2+ atoms. In the second Pt+0.67- site, Pt+0.67- is bonded in a distorted square co-planar geometry to four Zr2+ atoms.

36 MATERIALS SCIENCE↗