Materials Data on SeO4 by Materials Project

doi:10.17188/1682829

Title: Materials Data on SeO4 by Materials Project

Dataset

Abstract

SeO4 is Silicon tetrafluoride-like structured and crystallizes in the orthorhombic P2_12_12_1 space group. The structure is zero-dimensional and consists of four SeO4 clusters. Se is bonded in a tetrahedral geometry to four O atoms. There is one shorter (1.67 Å) and three longer (1.69 Å) Se–O bond length. There are four inequivalent O sites. In the first O site, O is bonded in a single-bond geometry to one Se atom. In the second O site, O is bonded in a single-bond geometry to one Se atom. In the third O site, O is bonded in a single-bond geometry to one Se atom. In the fourth O site, O is bonded in a single-bond geometry to one Se atom.

Authors:: The Materials Project

Publication Date:: 2020-05-02

Other Number(s):: mp-1179144

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; SeO4; O-Se

OSTI Identifier:: 1682829

DOI:: https://doi.org/10.17188/1682829

Citation Formats


                    The Materials Project. Materials Data on SeO4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1682829.

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                    The Materials Project. Materials Data on SeO4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1682829

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                    The Materials Project. 2020.  
"Materials Data on SeO4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1682829.  https://www.osti.gov/servlets/purl/1682829. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1682829,

  title        = {Materials Data on SeO4 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {SeO4 is Silicon tetrafluoride-like structured and crystallizes in the orthorhombic P2_12_12_1 space group. The structure is zero-dimensional and consists of four SeO4 clusters. Se is bonded in a tetrahedral geometry to four O atoms. There is one shorter (1.67 Å) and three longer (1.69 Å) Se–O bond length. There are four inequivalent O sites. In the first O site, O is bonded in a single-bond geometry to one Se atom. In the second O site, O is bonded in a single-bond geometry to one Se atom. In the third O site, O is bonded in a single-bond geometry to one Se atom. In the fourth O site, O is bonded in a single-bond geometry to one Se atom.},

  doi          = {10.17188/1682829},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1682829

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