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Title: Materials Data on CsNO3 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1198836· OSTI ID:1198836

CsNO3 crystallizes in the orthorhombic Pmmn space group. The structure is three-dimensional. Cs1+ is bonded to twelve O2- atoms to form a mixture of face, edge, and corner-sharing CsO12 cuboctahedra. There are a spread of Cs–O bond distances ranging from 3.21–3.41 Å. N5+ is bonded in a trigonal planar geometry to three O2- atoms. All N–O bond lengths are 1.27 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to four equivalent Cs1+ and one N5+ atom. In the second O2- site, O2- is bonded in a single-bond geometry to four equivalent Cs1+ and one N5+ atom.

Research Organization:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Contributing Organization:
MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231; EDCBEE
OSTI ID:
1198836
Report Number(s):
mp-22628
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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