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Title: Materials Data on NaAlSi by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1201540· OSTI ID:1201540

NaAlSi is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Na1+ is bonded in a 5-coordinate geometry to five equivalent Si4- atoms. There are one shorter (3.13 Å) and four longer (3.14 Å) Na–Si bond lengths. Al3+ is bonded to four equivalent Si4- atoms to form a mixture of edge and corner-sharing AlSi4 tetrahedra. All Al–Si bond lengths are 2.57 Å. Si4- is bonded in a 9-coordinate geometry to five equivalent Na1+ and four equivalent Al3+ 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:
1201540
Report Number(s):
mp-27335
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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