Materials Data on Ta4FeP by Materials Project

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

DOI:https://doi.org/10.17188/1197652· OSTI ID:1197652

The Materials Project

Ta4FeP is Khatyrkite-derived structured and crystallizes in the tetragonal P4/mcc space group. The structure is three-dimensional. Ta is bonded in a 4-coordinate geometry to two equivalent Fe and two equivalent P atoms. Both Ta–Fe bond lengths are 2.57 Å. Both Ta–P bond lengths are 2.66 Å. Fe is bonded in a 10-coordinate geometry to eight equivalent Ta and two equivalent Fe atoms. Both Fe–Fe bond lengths are 2.55 Å. P is bonded in a 10-coordinate geometry to eight equivalent Ta and two equivalent P atoms. Both P–P bond lengths are 2.55 Å.

• 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: 1197652
• Report Number(s): mp-22444
• Resource Relation: Related Information: https://materialsproject.org/citing
• Country of Publication: United States
• Language: English

Related Subjects

36 MATERIALS SCIENCE
crystal structure
Ta4FeP
Fe-P-Ta