Materials Data on K2CuPb(NO2)6 by Materials Project
Abstract
K2PbCu(NO2)6 crystallizes in the cubic F23 space group. The structure is three-dimensional and consists of four copper molecules and one K2Pb(NO2)6 framework. In the K2Pb(NO2)6 framework, there are two inequivalent K1+ sites. In the first K1+ site, K1+ is bonded to twelve equivalent O2- atoms to form edge-sharing KO12 cuboctahedra. All K–O bond lengths are 2.92 Å. In the second K1+ site, K1+ is bonded to twelve equivalent O2- atoms to form edge-sharing KO12 cuboctahedra. All K–O bond lengths are 3.21 Å. Pb2+ is bonded in a distorted q6 geometry to twelve equivalent O2- atoms. All Pb–O bond lengths are 2.72 Å. N3+ is bonded in a bent 120 degrees geometry to two equivalent O2- atoms. Both N–O bond lengths are 1.26 Å. O2- is bonded in a distorted single-bond geometry to two K1+, one Pb2+, and one N3+ atom.
- Authors:
- Publication Date:
- Other Number(s):
- mp-608162
- 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; K2CuPb(NO2)6; Cu-K-N-O-Pb
- OSTI Identifier:
- 1277608
- DOI:
- https://doi.org/10.17188/1277608
Citation Formats
The Materials Project. Materials Data on K2CuPb(NO2)6 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1277608.
The Materials Project. Materials Data on K2CuPb(NO2)6 by Materials Project. United States. doi:https://doi.org/10.17188/1277608
The Materials Project. 2020.
"Materials Data on K2CuPb(NO2)6 by Materials Project". United States. doi:https://doi.org/10.17188/1277608. https://www.osti.gov/servlets/purl/1277608. Pub date:Sat Jul 18 00:00:00 EDT 2020
@article{osti_1277608,
title = {Materials Data on K2CuPb(NO2)6 by Materials Project},
author = {The Materials Project},
abstractNote = {K2PbCu(NO2)6 crystallizes in the cubic F23 space group. The structure is three-dimensional and consists of four copper molecules and one K2Pb(NO2)6 framework. In the K2Pb(NO2)6 framework, there are two inequivalent K1+ sites. In the first K1+ site, K1+ is bonded to twelve equivalent O2- atoms to form edge-sharing KO12 cuboctahedra. All K–O bond lengths are 2.92 Å. In the second K1+ site, K1+ is bonded to twelve equivalent O2- atoms to form edge-sharing KO12 cuboctahedra. All K–O bond lengths are 3.21 Å. Pb2+ is bonded in a distorted q6 geometry to twelve equivalent O2- atoms. All Pb–O bond lengths are 2.72 Å. N3+ is bonded in a bent 120 degrees geometry to two equivalent O2- atoms. Both N–O bond lengths are 1.26 Å. O2- is bonded in a distorted single-bond geometry to two K1+, one Pb2+, and one N3+ atom.},
doi = {10.17188/1277608},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Sat Jul 18 00:00:00 EDT 2020},
month = {Sat Jul 18 00:00:00 EDT 2020}
}