Materials Data on NdSeF by Materials Project
NdSeF is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Nd3+ is bonded in a 9-coordinate geometry to five equivalent Se2- and four equivalent F1- atoms. There are four shorter (3.03 Å) and one longer (3.09 Å) Nd–Se bond lengths. All Nd–F bond lengths are 2.57 Å. Se2- is bonded in a 5-coordinate geometry to five equivalent Nd3+ and four equivalent F1- atoms. All Se–F bond lengths are 3.28 Å. F1- is bonded to four equivalent Nd3+ and four equivalent Se2- atoms to form a mixture of face and edge-sharing FNd4Se4 tetrahedra.
- 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:
- 1189086
- Report Number(s):
- mp-12620
- Country of Publication:
- United States
- Language:
- English
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