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Title: Materials Data on InAgTe2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1197604· OSTI ID:1197604

AgInTe2 is Chalcopyrite structured and crystallizes in the tetragonal I-42d space group. The structure is three-dimensional. Ag1+ is bonded to four equivalent Te2- atoms to form AgTe4 tetrahedra that share corners with four equivalent AgTe4 tetrahedra and corners with eight equivalent InTe4 tetrahedra. All Ag–Te bond lengths are 2.82 Å. In3+ is bonded to four equivalent Te2- atoms to form InTe4 tetrahedra that share corners with four equivalent InTe4 tetrahedra and corners with eight equivalent AgTe4 tetrahedra. All In–Te bond lengths are 2.85 Å. Te2- is bonded to two equivalent Ag1+ and two equivalent In3+ atoms to form corner-sharing TeIn2Ag2 tetrahedra.

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:
1197604
Report Number(s):
mp-22386
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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