Materials Data on KPO3 by Materials Project

doi:10.17188/1731538

Title: Materials Data on KPO3 by Materials Project

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Abstract

KPO3 crystallizes in the monoclinic C2/m space group. The structure is two-dimensional and consists of two KPO3 sheets oriented in the (1, 0, 0) direction. K1+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of K–O bond distances ranging from 2.73–2.83 Å. P5+ is bonded in a trigonal planar geometry to three O2- atoms. There is two shorter (1.49 Å) and one longer (1.50 Å) P–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent K1+ and one P5+ atom. In the second O2- site, O2- is bonded in a 1-coordinate geometry to one K1+ and one P5+ atom.

Publication Date:: Mon May 04 00:00:00 EDT 2020

Other Number(s):: mp-1223439

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; K-O-P; KPO3; crystal structure

OSTI Identifier:: 1731538

DOI:: https://doi.org/10.17188/1731538

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                    Materials Data on KPO3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1731538.

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                    Materials Data on KPO3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1731538

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                    2020.  
"Materials Data on KPO3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1731538.  https://www.osti.gov/servlets/purl/1731538. Pub date:Mon May 04 00:00:00 EDT 2020

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@article{osti_1731538,

  title        = {Materials Data on KPO3 by Materials Project},

  
  abstractNote = {KPO3 crystallizes in the monoclinic C2/m space group. The structure is two-dimensional and consists of two KPO3 sheets oriented in the (1, 0, 0) direction. K1+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of K–O bond distances ranging from 2.73–2.83 Å. P5+ is bonded in a trigonal planar geometry to three O2- atoms. There is two shorter (1.49 Å) and one longer (1.50 Å) P–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent K1+ and one P5+ atom. In the second O2- site, O2- is bonded in a 1-coordinate geometry to one K1+ and one P5+ atom.},

  doi          = {10.17188/1731538},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Mon May 04 00:00:00 EDT 2020},

  month        = {Mon May 04 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1731538

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Materials Data on KPO3 by Materials Project

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