Materials Data on MgH12(ClO6)2 by Materials Project
Abstract
Mg(H2O)6(ClO3)2 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of two magnesium;hexahydrate molecules and four ClO3 clusters. In each ClO3 cluster, there are three inequivalent O sites. In the first O site, O is bonded in a distorted single-bond geometry to one Cl atom. The O–Cl bond length is 1.51 Å. In the second O site, O is bonded in a distorted single-bond geometry to one Cl atom. The O–Cl bond length is 1.51 Å. In the third O site, O is bonded in a single-bond geometry to one Cl atom. The O–Cl bond length is 1.51 Å. Cl is bonded in a trigonal non-coplanar geometry to three O atoms.
- Authors:
- Publication Date:
- Other Number(s):
- mp-1202344
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- Research Org.:
- Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- Collaborations:
- MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE
- Keywords:
- crystal structure; MgH12(ClO6)2; Cl-H-Mg-O
- OSTI Identifier:
- 1725105
- DOI:
- https://doi.org/10.17188/1725105
Citation Formats
The Materials Project. Materials Data on MgH12(ClO6)2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1725105.
The Materials Project. Materials Data on MgH12(ClO6)2 by Materials Project. United States. doi:https://doi.org/10.17188/1725105
The Materials Project. 2020.
"Materials Data on MgH12(ClO6)2 by Materials Project". United States. doi:https://doi.org/10.17188/1725105. https://www.osti.gov/servlets/purl/1725105. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1725105,
title = {Materials Data on MgH12(ClO6)2 by Materials Project},
author = {The Materials Project},
abstractNote = {Mg(H2O)6(ClO3)2 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of two magnesium;hexahydrate molecules and four ClO3 clusters. In each ClO3 cluster, there are three inequivalent O sites. In the first O site, O is bonded in a distorted single-bond geometry to one Cl atom. The O–Cl bond length is 1.51 Å. In the second O site, O is bonded in a distorted single-bond geometry to one Cl atom. The O–Cl bond length is 1.51 Å. In the third O site, O is bonded in a single-bond geometry to one Cl atom. The O–Cl bond length is 1.51 Å. Cl is bonded in a trigonal non-coplanar geometry to three O atoms.},
doi = {10.17188/1725105},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}
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