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Title: Materials Data on K10Co4O9 by Materials Project

Abstract

K10Co4O9 crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are ten inequivalent K1+ sites. In the first K1+ site, K1+ is bonded in a distorted trigonal planar geometry to three O2- atoms. There are a spread of K–O bond distances ranging from 2.69–2.87 Å. In the second K1+ site, K1+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of K–O bond distances ranging from 2.65–3.06 Å. In the third K1+ site, K1+ is bonded in a distorted trigonal pyramidal geometry to four O2- atoms. There are a spread of K–O bond distances ranging from 2.66–2.72 Å. In the fourth K1+ site, K1+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of K–O bond distances ranging from 2.67–3.10 Å. In the fifth K1+ site, K1+ is bonded in a 3-coordinate geometry to three O2- atoms. There are two shorter (2.70 Å) and one longer (2.75 Å) K–O bond lengths. In the sixth K1+ site, K1+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of K–O bond distances ranging from 2.71–2.98 Å. In the seventh K1+ site, K1+ is bondedmore » in a 5-coordinate geometry to five O2- atoms. There are a spread of K–O bond distances ranging from 2.70–2.90 Å. In the eighth K1+ site, K1+ is bonded in a 4-coordinate geometry to five O2- atoms. There are a spread of K–O bond distances ranging from 2.61–3.30 Å. In the ninth K1+ site, K1+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of K–O bond distances ranging from 2.74–2.87 Å. In the tenth K1+ site, K1+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of K–O bond distances ranging from 2.68–2.86 Å. There are four inequivalent Co2+ sites. In the first Co2+ site, Co2+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of Co–O bond distances ranging from 1.81–1.99 Å. In the second Co2+ site, Co2+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of Co–O bond distances ranging from 1.81–1.91 Å. In the third Co2+ site, Co2+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of Co–O bond distances ranging from 1.80–1.94 Å. In the fourth Co2+ site, Co2+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of Co–O bond distances ranging from 1.81–1.99 Å. There are nine inequivalent O2- sites. In the first O2- site, O2- is bonded in a 6-coordinate geometry to five K1+ and one Co2+ atom. In the second O2- site, O2- is bonded in a 2-coordinate geometry to three K1+ and two Co2+ atoms. In the third O2- site, O2- is bonded in a 6-coordinate geometry to five K1+ and one Co2+ atom. In the fourth O2- site, O2- is bonded in a 1-coordinate geometry to five K1+ and one Co2+ atom. In the fifth O2- site, O2- is bonded in a 1-coordinate geometry to five K1+ and one Co2+ atom. In the sixth O2- site, O2- is bonded in a 6-coordinate geometry to five K1+ and one Co2+ atom. In the seventh O2- site, O2- is bonded in a 2-coordinate geometry to five K1+ and two Co2+ atoms. In the eighth O2- site, O2- is bonded in a 2-coordinate geometry to four K1+ and two Co2+ atoms. In the ninth O2- site, O2- is bonded in a distorted octahedral geometry to five K1+ and one Co2+ atom.« less

Authors:
Publication Date:
Other Number(s):
mp-690511
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; K10Co4O9; Co-K-O
OSTI Identifier:
1284502
DOI:
https://doi.org/10.17188/1284502

Citation Formats

The Materials Project. Materials Data on K10Co4O9 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1284502.
The Materials Project. Materials Data on K10Co4O9 by Materials Project. United States. doi:https://doi.org/10.17188/1284502
The Materials Project. 2020. "Materials Data on K10Co4O9 by Materials Project". United States. doi:https://doi.org/10.17188/1284502. https://www.osti.gov/servlets/purl/1284502. Pub date:Mon Aug 03 00:00:00 EDT 2020
@article{osti_1284502,
title = {Materials Data on K10Co4O9 by Materials Project},
author = {The Materials Project},
abstractNote = {K10Co4O9 crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are ten inequivalent K1+ sites. In the first K1+ site, K1+ is bonded in a distorted trigonal planar geometry to three O2- atoms. There are a spread of K–O bond distances ranging from 2.69–2.87 Å. In the second K1+ site, K1+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of K–O bond distances ranging from 2.65–3.06 Å. In the third K1+ site, K1+ is bonded in a distorted trigonal pyramidal geometry to four O2- atoms. There are a spread of K–O bond distances ranging from 2.66–2.72 Å. In the fourth K1+ site, K1+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of K–O bond distances ranging from 2.67–3.10 Å. In the fifth K1+ site, K1+ is bonded in a 3-coordinate geometry to three O2- atoms. There are two shorter (2.70 Å) and one longer (2.75 Å) K–O bond lengths. In the sixth K1+ site, K1+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of K–O bond distances ranging from 2.71–2.98 Å. In the seventh K1+ site, K1+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of K–O bond distances ranging from 2.70–2.90 Å. In the eighth K1+ site, K1+ is bonded in a 4-coordinate geometry to five O2- atoms. There are a spread of K–O bond distances ranging from 2.61–3.30 Å. In the ninth K1+ site, K1+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of K–O bond distances ranging from 2.74–2.87 Å. In the tenth K1+ site, K1+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of K–O bond distances ranging from 2.68–2.86 Å. There are four inequivalent Co2+ sites. In the first Co2+ site, Co2+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of Co–O bond distances ranging from 1.81–1.99 Å. In the second Co2+ site, Co2+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of Co–O bond distances ranging from 1.81–1.91 Å. In the third Co2+ site, Co2+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of Co–O bond distances ranging from 1.80–1.94 Å. In the fourth Co2+ site, Co2+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of Co–O bond distances ranging from 1.81–1.99 Å. There are nine inequivalent O2- sites. In the first O2- site, O2- is bonded in a 6-coordinate geometry to five K1+ and one Co2+ atom. In the second O2- site, O2- is bonded in a 2-coordinate geometry to three K1+ and two Co2+ atoms. In the third O2- site, O2- is bonded in a 6-coordinate geometry to five K1+ and one Co2+ atom. In the fourth O2- site, O2- is bonded in a 1-coordinate geometry to five K1+ and one Co2+ atom. In the fifth O2- site, O2- is bonded in a 1-coordinate geometry to five K1+ and one Co2+ atom. In the sixth O2- site, O2- is bonded in a 6-coordinate geometry to five K1+ and one Co2+ atom. In the seventh O2- site, O2- is bonded in a 2-coordinate geometry to five K1+ and two Co2+ atoms. In the eighth O2- site, O2- is bonded in a 2-coordinate geometry to four K1+ and two Co2+ atoms. In the ninth O2- site, O2- is bonded in a distorted octahedral geometry to five K1+ and one Co2+ atom.},
doi = {10.17188/1284502},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {8}
}