Materials Data on Np(IO3)2 by Materials Project

doi:10.17188/1672580

Title: Materials Data on Np(IO3)2 by Materials Project

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Abstract

Np(O3I)2 crystallizes in the tetragonal P4_2/n space group. The structure is three-dimensional. Np is bonded in an octahedral geometry to six O atoms. There are a spread of Np–O bond distances ranging from 1.89–2.24 Å. There are three inequivalent O sites. In the first O site, O is bonded in a bent 150 degrees geometry to one Np and one I atom. The O–I bond length is 1.88 Å. In the second O site, O is bonded in a distorted single-bond geometry to one Np and one I atom. The O–I bond length is 2.47 Å. In the third O site, O is bonded in a bent 120 degrees geometry to one Np and one I atom. The O–I bond length is 1.95 Å. I is bonded in a T-shaped geometry to three O atoms.

Authors:: The Materials Project

Publication Date:: 2019-01-12

Other Number(s):: mp-1212228

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; Np(IO3)2; I-Np-O

OSTI Identifier:: 1672580

DOI:: https://doi.org/10.17188/1672580

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                    The Materials Project. Materials Data on Np(IO3)2 by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1672580.

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                    The Materials Project. Materials Data on Np(IO3)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1672580

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                    The Materials Project. 2019.  
"Materials Data on Np(IO3)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1672580.  https://www.osti.gov/servlets/purl/1672580. Pub date:Sat Jan 12 00:00:00 EST 2019

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@article{osti_1672580,

  title        = {Materials Data on Np(IO3)2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Np(O3I)2 crystallizes in the tetragonal P4_2/n space group. The structure is three-dimensional. Np is bonded in an octahedral geometry to six O atoms. There are a spread of Np–O bond distances ranging from 1.89–2.24 Å. There are three inequivalent O sites. In the first O site, O is bonded in a bent 150 degrees geometry to one Np and one I atom. The O–I bond length is 1.88 Å. In the second O site, O is bonded in a distorted single-bond geometry to one Np and one I atom. The O–I bond length is 2.47 Å. In the third O site, O is bonded in a bent 120 degrees geometry to one Np and one I atom. The O–I bond length is 1.95 Å. I is bonded in a T-shaped geometry to three O atoms.},

  doi          = {10.17188/1672580},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2019},

  month        = {1}

}

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DOI: https://doi.org/10.17188/1672580

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