Materials Data on NdB2Ir3 by Materials Project

Dataset · Thu Jul 16 00:00:00 EDT 2020

DOI:https://doi.org/10.17188/1355239· OSTI ID:1355239

The Materials Project

NdIr3B2 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Nd is bonded in a 12-coordinate geometry to two equivalent Nd, twelve equivalent Ir, and six equivalent B atoms. Both Nd–Nd bond lengths are 3.12 Å. All Nd–Ir bond lengths are 3.19 Å. All Nd–B bond lengths are 3.21 Å. Ir is bonded in a distorted square co-planar geometry to four equivalent Nd and four equivalent B atoms. All Ir–B bond lengths are 2.24 Å. B is bonded in a 6-coordinate geometry to three equivalent Nd and six equivalent Ir 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: 1355239
• Report Number(s): mp-1025068
• Resource Relation: Related Information: https://materialsproject.org/citing
• Country of Publication: United States
• Language: English

Related Subjects

36 MATERIALS SCIENCE
crystal structure
NdB2Ir3
B-Ir-Nd