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Materials Data on Sr2Mg by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1714194· OSTI ID:1714194
Sr2Mg1 crystallizes in the monoclinic C2/m space group. The structure is two-dimensional and consists of one Sr2Mg1 sheet oriented in the (0, 0, 1) direction. there are two inequivalent Sr sites. In the first Sr site, Sr is bonded in a 12-coordinate geometry to three equivalent Mg atoms. There are one shorter (3.58 Å) and two longer (3.61 Å) Sr–Mg bond lengths. In the second Sr site, Sr is bonded in a 12-coordinate geometry to four equivalent Mg atoms. There are two shorter (3.70 Å) and two longer (3.81 Å) Sr–Mg bond lengths. Mg is bonded in a distorted q6 geometry to seven Sr and two equivalent Mg atoms. Both Mg–Mg bond lengths are 3.27 Å.
Research Organization:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Contributing Organization:
The Materials Project; MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231
OSTI ID:
1714194
Report Number(s):
mp-1094317
Country of Publication:
United States
Language:
English

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