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8 records
All sourcesNASA NTRSDOE OSTI
DOE OSTI2020

Materials Data on Zr3Rh5 by Materials Project

Zr3Rh5 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Zr sites. In the first Zr site, Zr is bonded in a 9-coordinate geometry to nine Rh atoms. There are a spread of Zr–Rh bond distances ranging from 2.63–2.99 Å. In the second Zr site, Zr is bonded in a 10-coordinate geometry to ten Rh atoms. There are a spread of Zr–Rh bond distances ranging from 2.75–2.98 Å. There are three inequivalent Rh sites. In the first Rh site, Rh is bonded in a 6-coordinate geometry to six Zr atoms. In the second Rh site, Rh is bonded in a 6-coordinate geometry to six Zr atoms. In the third Rh site, Rh is bonded in a 5-coordinate geometry to five Zr atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on ZrRh by Materials Project

ZrRh is Tetraauricupride structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Zr is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Zr–Rh bond lengths are 2.86 Å. Rh is bonded in a body-centered cubic geometry to eight equivalent Zr atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on ZrRh by Materials Project

ZrRh crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Zr sites. In the first Zr site, Zr is bonded in a body-centered cubic geometry to eight Rh atoms. There are a spread of Zr–Rh bond distances ranging from 2.71–2.89 Å. In the second Zr site, Zr is bonded in a 5-coordinate geometry to seven Rh atoms. There are a spread of Zr–Rh bond distances ranging from 2.70–3.22 Å. There are two inequivalent Rh sites. In the first Rh site, Rh is bonded in a 7-coordinate geometry to seven Zr atoms. In the second Rh site, Rh is bonded in a 8-coordinate geometry to eight Zr atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Zr2Rh by Materials Project

Zr2Rh is Khatyrkite structured and crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. Zr is bonded in a 4-coordinate geometry to four equivalent Rh atoms. All Zr–Rh bond lengths are 2.82 Å. Rh is bonded in a 10-coordinate geometry to eight equivalent Zr atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on ZrRh by Materials Project

ZrRh is alpha-derived structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Zr is bonded in a 7-coordinate geometry to seven equivalent Rh atoms. There are a spread of Zr–Rh bond distances ranging from 2.64–2.93 Å. Rh is bonded in a 7-coordinate geometry to seven equivalent Zr atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on ZrRh by Materials Project

ZrRh is Tetraauricupride structured and crystallizes in the monoclinic P2_1/m space group. The structure is three-dimensional. Zr is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. There are a spread of Zr–Rh bond distances ranging from 2.83–2.90 Å. Rh is bonded in a body-centered cubic geometry to eight equivalent Zr atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Zr3Rh by Materials Project

Zr3Rh crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Zr sites. In the first Zr site, Zr is bonded to eight Zr and four equivalent Rh atoms to form distorted ZrZr8Rh4 cuboctahedra that share corners with twelve equivalent ZrZr8Rh4 cuboctahedra, edges with eight equivalent ZrZr8Rh4 cuboctahedra, edges with eight equivalent RhZr12 cuboctahedra, faces with four equivalent RhZr12 cuboctahedra, and faces with ten equivalent ZrZr8Rh4 cuboctahedra. There are four shorter (2.85 Å) and four longer (3.22 Å) Zr–Zr bond lengths. All Zr–Rh bond lengths are 3.22 Å. In the second Zr site, Zr is bonded in a square co-planar geometry to eight equivalent Zr and four equivalent Rh atoms. All Zr–Rh bond lengths are 2.85 Å. Rh is bonded to twelve Zr atoms to form RhZr12 cuboctahedra that share corners with four equivalent RhZr12 cuboctahedra, edges with eight equivalent RhZr12 cuboctahedra, edges with sixteen equivalent ZrZr8Rh4 cuboctahedra, faces with four equivalent RhZr12 cuboctahedra, and faces with eight equivalent ZrZr8Rh4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Zr3Rh by Materials Project

Zr3Rh crystallizes in the tetragonal I-4 space group. The structure is three-dimensional. there are three inequivalent Zr sites. In the first Zr site, Zr is bonded in a distorted water-like geometry to two equivalent Rh atoms. Both Zr–Rh bond lengths are 2.81 Å. In the second Zr site, Zr is bonded in a water-like geometry to two equivalent Rh atoms. There are one shorter (2.79 Å) and one longer (2.80 Å) Zr–Rh bond lengths. In the third Zr site, Zr is bonded in a 4-coordinate geometry to four equivalent Rh atoms. There are a spread of Zr–Rh bond distances ranging from 2.72–2.96 Å. Rh is bonded in a 8-coordinate geometry to eight Zr atoms.

36 MATERIALS SCIENCE↗