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Title: Materials Data on Mo2C by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1191211· OSTI ID:1191211

Mo2C is beta Vanadium nitride-like structured and crystallizes in the orthorhombic Pbcn space group. The structure is three-dimensional. Mo2+ is bonded in a distorted T-shaped geometry to three equivalent C4- atoms. There are a spread of Mo–C bond distances ranging from 2.11–2.14 Å. C4- is bonded to six equivalent Mo2+ atoms to form a mixture of corner and edge-sharing CMo6 octahedra. The corner-sharing octahedra tilt angles range from 49–50°.

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:
1191211
Report Number(s):
mp-1552
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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