Materials Data on FeS2 by Materials Project
FeS2 is Pyrite structured and crystallizes in the cubic Pa-3 space group. The structure is three-dimensional. Fe3+ is bonded to six equivalent S+1.50- atoms to form corner-sharing FeS6 octahedra. The corner-sharing octahedral tilt angles are 64°. All Fe–S bond lengths are 2.25 Å. S+1.50- is bonded in a 3-coordinate geometry to three equivalent Fe3+ atoms.
- 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:
- 1183906
- Report Number(s):
- mp-226
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
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