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Title: Materials Data on LaB2Ir2C by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1277219· OSTI ID:1277219

LaIr2B2C crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. La3+ is bonded in a square co-planar geometry to four equivalent C4- atoms. All La–C bond lengths are 2.75 Å. Ir+3.50+ is bonded to four equivalent B3- atoms to form a mixture of edge and corner-sharing IrB4 tetrahedra. All Ir–B bond lengths are 2.24 Å. B3- is bonded in a distorted single-bond geometry to four equivalent Ir+3.50+ and one C4- atom. The B–C bond length is 1.52 Å. C4- is bonded in a distorted linear geometry to four equivalent La3+ and two equivalent B3- 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:
1277219
Report Number(s):
mp-5992
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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