Materials Data on Ni(ClO3)2 by Materials Project

doi:10.17188/1742162

Title: Materials Data on Ni(ClO3)2 by Materials Project

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Abstract

Ni(O3Cl)2 crystallizes in the monoclinic C2/m space group. The structure is one-dimensional and consists of two Ni(O3Cl)2 ribbons oriented in the (0, 1, 0) direction. Ni is bonded in a distorted octahedral geometry to four equivalent O and two equivalent Cl atoms. All Ni–O bond lengths are 2.09 Å. Both Ni–Cl bond lengths are 2.50 Å. There are two inequivalent O sites. In the first O site, O is bonded in a bent 120 degrees geometry to two equivalent O atoms. Both O–O bond lengths are 1.34 Å. In the second O site, O is bonded in a water-like geometry to one Ni and one O atom. Cl is bonded in a distorted single-bond geometry to one Ni atom.

Authors:: The Materials Project

Publication Date:: Sat May 02 00:00:00 EDT 2020

Other Number(s):: mp-1084850

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; Ni(ClO3)2; Cl-Ni-O

OSTI Identifier:: 1742162

DOI:: https://doi.org/10.17188/1742162

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                    The Materials Project. Materials Data on Ni(ClO3)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1742162.

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                    The Materials Project. Materials Data on Ni(ClO3)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1742162

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                    The Materials Project. 2020.  
"Materials Data on Ni(ClO3)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1742162.  https://www.osti.gov/servlets/purl/1742162. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1742162,

  title        = {Materials Data on Ni(ClO3)2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Ni(O3Cl)2 crystallizes in the monoclinic C2/m space group. The structure is one-dimensional and consists of two Ni(O3Cl)2 ribbons oriented in the (0, 1, 0) direction. Ni is bonded in a distorted octahedral geometry to four equivalent O and two equivalent Cl atoms. All Ni–O bond lengths are 2.09 Å. Both Ni–Cl bond lengths are 2.50 Å. There are two inequivalent O sites. In the first O site, O is bonded in a bent 120 degrees geometry to two equivalent O atoms. Both O–O bond lengths are 1.34 Å. In the second O site, O is bonded in a water-like geometry to one Ni and one O atom. Cl is bonded in a distorted single-bond geometry to one Ni atom.},

  doi          = {10.17188/1742162},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat May 02 00:00:00 EDT 2020},

  month        = {Sat May 02 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1742162

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