Materials Data on Rb2U(ClO)4 by Materials Project
Rb2U(OCl)4 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. Rb is bonded in a 9-coordinate geometry to four O and five Cl atoms. There are a spread of Rb–O bond distances ranging from 2.97–3.25 Å. There are a spread of Rb–Cl bond distances ranging from 3.35–3.75 Å. U is bonded in a distorted octahedral geometry to two equivalent O and four Cl atoms. Both U–O bond lengths are 1.82 Å. There are two shorter (2.64 Å) and two longer (2.70 Å) U–Cl bond lengths. There are two inequivalent O sites. In the first O site, O is bonded in a distorted single-bond geometry to two equivalent Rb and one U atom. In the second O site, O is bonded in a distorted bent 120 degrees geometry to two equivalent Rb atoms. There are two inequivalent Cl sites. In the first Cl site, Cl is bonded in a 3-coordinate geometry to two equivalent Rb and one U atom. In the second Cl site, Cl is bonded in a 1-coordinate geometry to three equivalent Rb and one U 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:
- 1674724
- Report Number(s):
- mp-1103676
- Country of Publication:
- United States
- Language:
- English
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