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Title: Materials Data on Cs2SiAs2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1276521· OSTI ID:1276521

Cs2SiAs2 crystallizes in the orthorhombic Ibam space group. The structure is three-dimensional. Cs1+ is bonded in a 6-coordinate geometry to six equivalent As3- atoms. There are a spread of Cs–As bond distances ranging from 3.63–4.04 Å. Si4+ is bonded to four equivalent As3- atoms to form distorted edge-sharing SiAs4 tetrahedra. All Si–As bond lengths are 2.42 Å. As3- is bonded in a 2-coordinate geometry to six equivalent Cs1+ and two equivalent Si4+ 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:
1276521
Report Number(s):
mp-573721
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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