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Title: Materials Data on CaO by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1267072· OSTI ID:1267072

CaO crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Ca2+ is bonded to five equivalent O2- atoms to form a mixture of edge and corner-sharing CaO5 trigonal bipyramids. There are three shorter (2.31 Å) and two longer (2.41 Å) Ca–O bond lengths. O2- is bonded to five equivalent Ca2+ atoms to form a mixture of edge and corner-sharing OCa5 trigonal bipyramids.

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:
1267072
Report Number(s):
mp-545512
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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