Materials Data on FeTc2Cl by Materials Project

Dataset · Fri Jul 24 00:00:00 EDT 2020

DOI:https://doi.org/10.17188/1279143· OSTI ID:1279143

The Materials Project

Tc2FeCl is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Tc1- is bonded in a distorted body-centered cubic geometry to four equivalent Fe3+ and four equivalent Cl1- atoms. All Tc–Fe bond lengths are 2.60 Å. All Tc–Cl bond lengths are 2.60 Å. Fe3+ is bonded in a 8-coordinate geometry to eight equivalent Tc1- and six equivalent Cl1- atoms. All Fe–Cl bond lengths are 3.00 Å. Cl1- is bonded in a distorted body-centered cubic geometry to eight equivalent Tc1- and six equivalent Fe3+ 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: 1279143
• Report Number(s): mp-631425
• Resource Relation: Related Information: https://materialsproject.org/citing
• Country of Publication: United States
• Language: English

Related Subjects

36 MATERIALS SCIENCE
crystal structure
FeTc2Cl
Cl-Fe-Tc