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Title: Materials Data on ThBC by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1275604· OSTI ID:1275604

ThBC crystallizes in the tetragonal P4_122 space group. The structure is two-dimensional and consists of four ThBC sheets oriented in the (0, 0, 1) direction. Th is bonded in a 5-coordinate geometry to five equivalent C atoms. There are a spread of Th–C bond distances ranging from 2.48–2.73 Å. B is bonded in a distorted single-bond geometry to one C atom. The B–C bond length is 1.50 Å. C is bonded in a 6-coordinate geometry to five equivalent Th and one B 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:
1275604
Report Number(s):
mp-570254
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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