Materials Data on Ho2(SeO3)3 by Materials Project

doi:10.17188/1298554

Title: Materials Data on Ho2(SeO3)3 by Materials Project

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Abstract

Ho2(SeO3)3 crystallizes in the hexagonal P6_3/m space group. The structure is three-dimensional. Ho3+ is bonded to six O2- atoms to form distorted face-sharing HoO6 octahedra. There are three shorter (2.18 Å) and three longer (2.35 Å) Ho–O bond lengths. Se4+ is bonded in a trigonal non-coplanar geometry to three O2- atoms. There is two shorter (1.71 Å) and one longer (1.76 Å) Se–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a bent 150 degrees geometry to one Ho3+ and one Se4+ atom. In the second O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Ho3+ and one Se4+ atom.

Publication Date:: Wed May 10 00:00:00 EDT 2017

Other Number(s):: mp-768920

DOE Contract Number:: AC02-05CH11231

Research Org.:: LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

Sponsoring Org.:: USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)

Collaborations:: The Materials Project; MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE; Ho-O-Se; Ho2(SeO3)3; crystal structure

OSTI Identifier:: 1298554

DOI:: https://doi.org/10.17188/1298554

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                    Materials Data on Ho2(SeO3)3 by Materials Project.  United States: N. p., 2017. 
        Web.  doi:10.17188/1298554.

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                    Materials Data on Ho2(SeO3)3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1298554

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                    2017.  
"Materials Data on Ho2(SeO3)3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1298554.  https://www.osti.gov/servlets/purl/1298554. Pub date:Wed May 10 00:00:00 EDT 2017

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@article{osti_1298554,

  title        = {Materials Data on Ho2(SeO3)3 by Materials Project},

  
  abstractNote = {Ho2(SeO3)3 crystallizes in the hexagonal P6_3/m space group. The structure is three-dimensional. Ho3+ is bonded to six O2- atoms to form distorted face-sharing HoO6 octahedra. There are three shorter (2.18 Å) and three longer (2.35 Å) Ho–O bond lengths. Se4+ is bonded in a trigonal non-coplanar geometry to three O2- atoms. There is two shorter (1.71 Å) and one longer (1.76 Å) Se–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a bent 150 degrees geometry to one Ho3+ and one Se4+ atom. In the second O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Ho3+ and one Se4+ atom.},

  doi          = {10.17188/1298554},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Wed May 10 00:00:00 EDT 2017},

  month        = {Wed May 10 00:00:00 EDT 2017}

}

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DOI: https://doi.org/10.17188/1298554

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