Materials Data on Rb3U3Ge2O13 by Materials Project
Abstract
Rb3U3Ge2O13 crystallizes in the hexagonal P-62c space group. The structure is three-dimensional. Rb1+ is bonded in a 12-coordinate geometry to twelve O2- atoms. There are a spread of Rb–O bond distances ranging from 3.05–3.55 Å. U5+ is bonded to six O2- atoms to form UO6 octahedra that share corners with four equivalent UO6 octahedra and corners with two equivalent GeO4 tetrahedra. The corner-sharing octahedra tilt angles range from 6–35°. There are a spread of U–O bond distances ranging from 2.13–2.22 Å. Ge4+ is bonded to four O2- atoms to form GeO4 tetrahedra that share corners with three equivalent UO6 octahedra and a cornercorner with one GeO4 tetrahedra. The corner-sharing octahedral tilt angles are 25°. There is three shorter (1.76 Å) and one longer (1.77 Å) Ge–O bond length. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a 2-coordinate geometry to three equivalent Rb1+, one U5+, and one Ge4+ atom. In the second O2- site, O2- is bonded in a linear geometry to three equivalent Rb1+ and two equivalent U5+ atoms. In the third O2- site, O2- is bonded in a linear geometry to three equivalent Rb1+ and two equivalent Ge4+ atoms. In themore »
- Authors:
- Publication Date:
- Other Number(s):
- mp-557381
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- Research Org.:
- Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- Collaborations:
- MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE
- Keywords:
- crystal structure; Rb3U3Ge2O13; Ge-O-Rb-U
- OSTI Identifier:
- 1269812
- DOI:
- https://doi.org/10.17188/1269812
Citation Formats
The Materials Project. Materials Data on Rb3U3Ge2O13 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1269812.
The Materials Project. Materials Data on Rb3U3Ge2O13 by Materials Project. United States. doi:https://doi.org/10.17188/1269812
The Materials Project. 2020.
"Materials Data on Rb3U3Ge2O13 by Materials Project". United States. doi:https://doi.org/10.17188/1269812. https://www.osti.gov/servlets/purl/1269812. Pub date:Wed Apr 29 00:00:00 EDT 2020
@article{osti_1269812,
title = {Materials Data on Rb3U3Ge2O13 by Materials Project},
author = {The Materials Project},
abstractNote = {Rb3U3Ge2O13 crystallizes in the hexagonal P-62c space group. The structure is three-dimensional. Rb1+ is bonded in a 12-coordinate geometry to twelve O2- atoms. There are a spread of Rb–O bond distances ranging from 3.05–3.55 Å. U5+ is bonded to six O2- atoms to form UO6 octahedra that share corners with four equivalent UO6 octahedra and corners with two equivalent GeO4 tetrahedra. The corner-sharing octahedra tilt angles range from 6–35°. There are a spread of U–O bond distances ranging from 2.13–2.22 Å. Ge4+ is bonded to four O2- atoms to form GeO4 tetrahedra that share corners with three equivalent UO6 octahedra and a cornercorner with one GeO4 tetrahedra. The corner-sharing octahedral tilt angles are 25°. There is three shorter (1.76 Å) and one longer (1.77 Å) Ge–O bond length. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a 2-coordinate geometry to three equivalent Rb1+, one U5+, and one Ge4+ atom. In the second O2- site, O2- is bonded in a linear geometry to three equivalent Rb1+ and two equivalent U5+ atoms. In the third O2- site, O2- is bonded in a linear geometry to three equivalent Rb1+ and two equivalent Ge4+ atoms. In the fourth O2- site, O2- is bonded in a distorted bent 150 degrees geometry to two equivalent Rb1+ and two equivalent U5+ atoms.},
doi = {10.17188/1269812},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Wed Apr 29 00:00:00 EDT 2020},
month = {Wed Apr 29 00:00:00 EDT 2020}
}