Materials Data on BAsO4 by Materials Project

doi:10.17188/1206376

Title: Materials Data on BAsO4 by Materials Project

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Abstract

BAsO4 crystallizes in the tetragonal I-4 space group. The structure is three-dimensional. B3+ is bonded to four equivalent O2- atoms to form BO4 tetrahedra that share corners with four equivalent AsO4 tetrahedra. All B–O bond lengths are 1.48 Å. As5+ is bonded to four equivalent O2- atoms to form AsO4 tetrahedra that share corners with four equivalent BO4 tetrahedra. All As–O bond lengths are 1.72 Å. O2- is bonded in a bent 120 degrees geometry to one B3+ and one As5+ atom.

Publication Date:: 2020-07-15

Other Number(s):: mp-3277

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; As-B-O; BAsO4; crystal structure

OSTI Identifier:: 1206376

DOI:: https://doi.org/10.17188/1206376

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                    Materials Data on BAsO4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1206376.

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                    Materials Data on BAsO4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1206376

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                    2020.  
"Materials Data on BAsO4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1206376.  https://www.osti.gov/servlets/purl/1206376. Pub date:Wed Jul 15 20:00:00 EDT 2020

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@article{osti_1206376,

  title        = {Materials Data on BAsO4 by Materials Project},

  
  abstractNote = {BAsO4 crystallizes in the tetragonal I-4 space group. The structure is three-dimensional. B3+ is bonded to four equivalent O2- atoms to form BO4 tetrahedra that share corners with four equivalent AsO4 tetrahedra. All B–O bond lengths are 1.48 Å. As5+ is bonded to four equivalent O2- atoms to form AsO4 tetrahedra that share corners with four equivalent BO4 tetrahedra. All As–O bond lengths are 1.72 Å. O2- is bonded in a bent 120 degrees geometry to one B3+ and one As5+ atom.},

  doi          = {10.17188/1206376},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1206376

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