Materials Data on Y2Ru2O7 by Materials Project
Y2Ru2O7 crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Y3+ is bonded in a body-centered cubic geometry to eight O2- atoms. There are two shorter (2.22 Å) and six longer (2.47 Å) Y–O bond lengths. Ru4+ is bonded to six equivalent O2- atoms to form corner-sharing RuO6 octahedra. The corner-sharing octahedral tilt angles are 52°. All Ru–O bond lengths are 2.02 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to four equivalent Y3+ atoms to form OY4 tetrahedra that share corners with sixteen OY4 tetrahedra and edges with six equivalent OY2Ru2 tetrahedra. In the second O2- site, O2- is bonded to two equivalent Y3+ and two equivalent Ru4+ atoms to form a mixture of distorted edge and corner-sharing OY2Ru2 tetrahedra.
- Research Organization:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Organization:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Contributing Organization:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- DOE Contract Number:
- AC02-05CH11231
- OSTI ID:
- 1195774
- Report Number(s):
- mp-20643
- Country of Publication:
- United States
- Language:
- English
Similar Records
Materials Data on Tb2Ru2O7 by Materials Project
Materials Data on Y2Ir2O7 by Materials Project
Materials Data on Dy2Ru2O7 by Materials Project
Dataset
·
Sat Jul 18 00:00:00 EDT 2020
·
OSTI ID:1191042
Materials Data on Y2Ir2O7 by Materials Project
Dataset
·
Tue Jul 21 00:00:00 EDT 2020
·
OSTI ID:1653735
Materials Data on Dy2Ru2O7 by Materials Project
Dataset
·
Wed Jul 15 00:00:00 EDT 2020
·
OSTI ID:1190975