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Title: Materials Data on CaUS2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1206542· OSTI ID:1206542

CaUS2 crystallizes in the tetragonal I-42d space group. The structure is three-dimensional. Ca is bonded in a distorted rectangular see-saw-like geometry to four equivalent S atoms. All Ca–S bond lengths are 2.72 Å. U is bonded in a 4-coordinate geometry to four equivalent S atoms. There are two shorter (2.74 Å) and two longer (2.76 Å) U–S bond lengths. S is bonded in a distorted rectangular see-saw-like geometry to two equivalent Ca and two equivalent U 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:
1206542
Report Number(s):
mp-33320
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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