Materials Data on NdAsPd by Materials Project

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

DOI:https://doi.org/10.17188/1312857· OSTI ID:1312857

The Materials Project

NdPdAs is hexagonal omega structure-derived structured and crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. Nd is bonded to six equivalent Pd and six equivalent As atoms to form a mixture of edge and face-sharing NdAs6Pd6 cuboctahedra. There are three shorter (3.14 Å) and three longer (3.27 Å) Nd–Pd bond lengths. There are three shorter (3.14 Å) and three longer (3.27 Å) Nd–As bond lengths. Pd is bonded in a 9-coordinate geometry to six equivalent Nd and three equivalent As atoms. All Pd–As bond lengths are 2.54 Å. As is bonded in a 9-coordinate geometry to six equivalent Nd and three equivalent Pd 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: 1312857
• Report Number(s): mp-8950
• Resource Relation: Related Information: https://materialsproject.org/citing
• Country of Publication: United States
• Language: English

Related Subjects

36 MATERIALS SCIENCE
crystal structure
NdAsPd
As-Nd-Pd