Materials Data on HfC by Materials Project
HfC is Molybdenum Carbide MAX Phase-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Hf4+ is bonded in a 6-coordinate geometry to six equivalent C4- atoms. All Hf–C bond lengths are 2.33 Å. C4- is bonded to six equivalent Hf4+ atoms to form a mixture of corner, edge, and face-sharing CHf6 octahedra. The corner-sharing octahedral tilt angles are 49°.
- Research Organization:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Organization:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Contributing Organization:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- DOE Contract Number:
- AC02-05CH11231
- OSTI ID:
- 1734320
- Report Number(s):
- mp-1096993
- Country of Publication:
- United States
- Language:
- English
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