Materials Data on Sm3V by Materials Project
Sm3V is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Sm sites. In the first Sm site, Sm is bonded to four equivalent Sm and four equivalent V atoms to form a mixture of distorted face, edge, and corner-sharing SmSm4V4 tetrahedra. All Sm–Sm bond lengths are 3.34 Å. All Sm–V bond lengths are 3.34 Å. In the second Sm site, Sm is bonded in a 8-coordinate geometry to eight equivalent Sm and six equivalent V atoms. All Sm–V bond lengths are 3.86 Å. V is bonded in a distorted body-centered cubic geometry to fourteen Sm 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:
- 1313841
- Report Number(s):
- mp-972456
- Country of Publication:
- United States
- Language:
- English
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