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Title: Materials Data on Eu2SiCl2O3 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1268755· OSTI ID:1268755

Eu2SiO3Cl2 crystallizes in the tetragonal I4/m space group. The structure is three-dimensional. Eu2+ is bonded in a 7-coordinate geometry to four O2- and three Cl1- atoms. There are a spread of Eu–O bond distances ranging from 2.48–2.82 Å. There are a spread of Eu–Cl bond distances ranging from 2.95–2.97 Å. Si4+ is bonded to four O2- atoms to form corner-sharing SiO4 tetrahedra. There is two shorter (1.62 Å) and two longer (1.67 Å) Si–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted bent 150 degrees geometry to two equivalent Eu2+ and two equivalent Si4+ atoms. In the second O2- site, O2- is bonded in a 4-coordinate geometry to three equivalent Eu2+ and one Si4+ atom. There are three inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a square co-planar geometry to four equivalent Eu2+ atoms. In the second Cl1- site, Cl1- is bonded in a 2-coordinate geometry to two equivalent Eu2+ atoms. In the third Cl1- site, Cl1- is bonded in a square co-planar geometry to four equivalent Eu2+ 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:
1268755
Report Number(s):
mp-555322
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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