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Materials Data on Zn2PtO4 by Materials Project

Zn2PtO4 is Spinel-like structured and crystallizes in the orthorhombic Imma space group. The structure is three-dimensional. Pt4+ is bonded to six O2- atoms to form PtO6 octahedra that share corners with six equivalent ZnO4 tetrahedra, edges with two equivalent PtO6 octahedra, and edges with four equivalent ZnO6 octahedra. There are two shorter (2.05 Å) and four longer (2.06 Å) Pt–O bond lengths. There are two inequivalent Zn2+ sites. In the first Zn2+ site, Zn2+ is bonded to four O2- atoms to form ZnO4 tetrahedra that share corners with six equivalent PtO6 octahedra and corners with six equivalent ZnO6 octahedra. The corner-sharing octahedra tilt angles range from 55–62°. There are two shorter (1.97 Å) and two longer (2.10 Å) Zn–O bond lengths. In the second Zn2+ site, Zn2+ is bonded to six O2- atoms to form ZnO6 octahedra that share corners with six equivalent ZnO4 tetrahedra, edges with two equivalent ZnO6 octahedra, and edges with four equivalent PtO6 octahedra. There are four shorter (2.08 Å) and two longer (2.22 Å) Zn–O bond lengths. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to one Pt4+ and three Zn2+ atoms to form a mixture of distorted corner and edge-sharing OZn3Pt trigonal pyramids. In the second O2- site, O2- is bonded in a distorted rectangular see-saw-like geometry to two equivalent Pt4+ and two Zn2+ atoms.

36 MATERIALS SCIENCE↗

Materials Data on Zn(PtO2)3 by Materials Project

Zn(PtO2)3 crystallizes in the orthorhombic Cmmm space group. The structure is three-dimensional. there are two inequivalent Pt+3.33+ sites. In the first Pt+3.33+ site, Pt+3.33+ is bonded to six O2- atoms to form a mixture of edge and corner-sharing PtO6 octahedra. The corner-sharing octahedral tilt angles are 59°. There are four shorter (2.05 Å) and two longer (2.07 Å) Pt–O bond lengths. In the second Pt+3.33+ site, Pt+3.33+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Pt–O bond lengths are 1.99 Å. Zn2+ is bonded in a distorted body-centered cubic geometry to eight O2- atoms. There are four shorter (2.20 Å) and four longer (2.45 Å) Zn–O bond lengths. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to three Pt+3.33+ and one Zn2+ atom to form a mixture of distorted edge and corner-sharing OZnPt3 tetrahedra. In the second O2- site, O2- is bonded to two equivalent Pt+3.33+ and two equivalent Zn2+ atoms to form a mixture of edge and corner-sharing OZn2Pt2 tetrahedra.

36 MATERIALS SCIENCE↗

Materials Data on ZnPt3O4 by Materials Project

Pt3ZnO4 crystallizes in the cubic Pm-3n space group. The structure is three-dimensional. Pt2+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Pt–O bond lengths are 2.05 Å. Zn2+ is bonded in a body-centered cubic geometry to eight equivalent O2- atoms. All Zn–O bond lengths are 2.52 Å. O2- is bonded to three equivalent Pt2+ and two equivalent Zn2+ atoms to form a mixture of edge and corner-sharing OZn2Pt3 trigonal bipyramids.

36 MATERIALS SCIENCE↗