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Title: Materials Data on CaSiPt by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1312882· OSTI ID:1312882

CaPtSi crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Ca2+ is bonded in a 5-coordinate geometry to five equivalent Si4- atoms. There are a spread of Ca–Si bond distances ranging from 3.04–3.24 Å. Pt2+ is bonded in a trigonal planar geometry to three equivalent Si4- atoms. There are a spread of Pt–Si bond distances ranging from 2.38–2.46 Å. Si4- is bonded in a 3-coordinate geometry to five equivalent Ca2+ and three equivalent Pt2+ 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:
1312882
Report Number(s):
mp-8982
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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