Materials Data on Mo3P by Materials Project
Mo3P crystallizes in the tetragonal I-42m space group. The structure is three-dimensional. there are three inequivalent Mo sites. In the first Mo site, Mo is bonded in a 3-coordinate geometry to twelve Mo and two equivalent P atoms. There are a spread of Mo–Mo bond distances ranging from 2.58–3.16 Å. Both Mo–P bond lengths are 2.52 Å. In the second Mo site, Mo is bonded in a 4-coordinate geometry to two equivalent Mo and four equivalent P atoms. All Mo–P bond lengths are 2.50 Å. In the third Mo site, Mo is bonded in a 2-coordinate geometry to five equivalent Mo and two equivalent P atoms. Both Mo–P bond lengths are 2.45 Å. P is bonded in a 8-coordinate geometry to eight Mo 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:
- 1184817
- Report Number(s):
- mp-10004
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
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