Materials Data on YbH2ClO2 by Materials Project
YbH2O2Cl crystallizes in the orthorhombic Pnma space group. The structure is two-dimensional and consists of two YbH2O2Cl sheets oriented in the (0, 0, 1) direction. Yb3+ is bonded in a 6-coordinate geometry to six O2- and two equivalent Cl1- atoms. There are a spread of Yb–O bond distances ranging from 2.31–2.53 Å. Both Yb–Cl bond lengths are 2.95 Å. There are two inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.98 Å. In the second H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.98 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to three equivalent Yb3+, one H1+, and one Cl1- atom. The O–Cl bond length is 2.43 Å. In the second O2- site, O2- is bonded in a distorted single-bond geometry to three equivalent Yb3+ and one H1+ atom. Cl1- is bonded in a 3-coordinate geometry to two equivalent Yb3+ and one O2- atom.
- 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:
- 1738673
- Report Number(s):
- mp-1191250
- Country of Publication:
- United States
- Language:
- English
Similar Records
Materials Data on YbH2ClO2 by Materials Project
Materials Data on YbH18(BrO6)3 by Materials Project
Materials Data on GdH2ClO2 by Materials Project
Dataset
·
Wed Jul 15 00:00:00 EDT 2020
·
OSTI ID:1316190
Materials Data on YbH18(BrO6)3 by Materials Project
Dataset
·
Fri Jan 11 23:00:00 EST 2019
·
OSTI ID:1734019
Materials Data on GdH2ClO2 by Materials Project
Dataset
·
Sat May 02 00:00:00 EDT 2020
·
OSTI ID:1701050