Materials Data on MoP3 by Materials Project
MoP3 is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Mo6+ is bonded in a distorted body-centered cubic geometry to fourteen P2- atoms. There are eight shorter (2.63 Å) and six longer (3.03 Å) Mo–P bond lengths. There are two inequivalent P2- sites. In the first P2- site, P2- is bonded in a body-centered cubic geometry to four equivalent Mo6+ and four equivalent P2- atoms. All P–P bond lengths are 2.63 Å. In the second P2- site, P2- is bonded in a distorted body-centered cubic geometry to six equivalent Mo6+ and eight equivalent P2- atoms.
- 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:
- 1667265
- Report Number(s):
- mp-1186023
- Country of Publication:
- United States
- Language:
- English
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