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Title: Materials Data on TlInS2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1742156· OSTI ID:1742156

TlInS2 crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. Tl1+ is bonded in a 10-coordinate geometry to eight equivalent S2- atoms. All Tl–S bond lengths are 3.44 Å. In3+ is bonded to four equivalent S2- atoms to form edge-sharing InS4 tetrahedra. All In–S bond lengths are 2.52 Å. S2- is bonded in a distorted L-shaped geometry to four equivalent Tl1+ and two equivalent In3+ 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:
1742156
Report Number(s):
mp-1078621
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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