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Title: Materials Data on Hf2InC by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1197383· OSTI ID:1197383

Hf2InC is H-Phase structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Hf is bonded in a 3-coordinate geometry to three equivalent In and three equivalent C atoms. All Hf–In bond lengths are 3.16 Å. All Hf–C bond lengths are 2.27 Å. In is bonded to six equivalent Hf atoms to form distorted InHf6 cuboctahedra that share corners with six equivalent CHf6 octahedra, edges with six equivalent InHf6 cuboctahedra, and edges with six equivalent CHf6 octahedra. The corner-sharing octahedral tilt angles are 20°. C is bonded to six equivalent Hf atoms to form CHf6 octahedra that share corners with six equivalent InHf6 cuboctahedra, edges with six equivalent InHf6 cuboctahedra, and edges with six equivalent CHf6 octahedra.

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:
1197383
Report Number(s):
mp-22156
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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