Materials Data on Nd(P3Ru)4 by Materials Project
Nd(RuP3)4 crystallizes in the cubic Im-3 space group. The structure is three-dimensional. Nd3+ is bonded to twelve equivalent P1- atoms to form NdP12 cuboctahedra that share faces with eight equivalent RuP6 octahedra. All Nd–P bond lengths are 3.12 Å. Ru+2.25+ is bonded to six equivalent P1- atoms to form RuP6 octahedra that share corners with six equivalent RuP6 octahedra and faces with two equivalent NdP12 cuboctahedra. The corner-sharing octahedral tilt angles are 62°. All Ru–P bond lengths are 2.37 Å. P1- is bonded in a 5-coordinate geometry to one Nd3+, two equivalent Ru+2.25+, and two equivalent P1- atoms. There are one shorter (2.31 Å) and one longer (2.33 Å) P–P bond lengths.
- 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:
- 1741968
- Report Number(s):
- mp-1189367
- Country of Publication:
- United States
- Language:
- English
Similar Records
Materials Data on Pr(P3Ru)4 by Materials Project
Materials Data on La(P3Ru)4 by Materials Project
Materials Data on Ce(P3Ru)4 by Materials Project
Dataset
·
Tue Jul 14 00:00:00 EDT 2020
·
OSTI ID:1208083
Materials Data on La(P3Ru)4 by Materials Project
Dataset
·
Wed Jul 15 00:00:00 EDT 2020
·
OSTI ID:1191342
Materials Data on Ce(P3Ru)4 by Materials Project
Dataset
·
Tue Jul 14 00:00:00 EDT 2020
·
OSTI ID:1185098