Materials Data on KMgH3 by Materials Project

doi:10.17188/1349817

Title: Materials Data on KMgH3 by Materials Project

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Abstract

KMgH3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one magnesium molecule and one KH3 framework. In the KH3 framework, K1+ is bonded to six equivalent H1- atoms to form corner-sharing KH6 octahedra. The corner-sharing octahedral tilt angles are 0°. All K–H bond lengths are 2.22 Å. H1- is bonded in a linear geometry to two equivalent K1+ atoms.

Publication Date:: 2020-05-03

Other Number(s):: mp-1017580

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; H-K-Mg; KMgH3; crystal structure

OSTI Identifier:: 1349817

DOI:: https://doi.org/10.17188/1349817

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                    Materials Data on KMgH3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1349817.

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                    Materials Data on KMgH3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1349817

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                    2020.  
"Materials Data on KMgH3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1349817.  https://www.osti.gov/servlets/purl/1349817. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1349817,

  title        = {Materials Data on KMgH3 by Materials Project},

  
  abstractNote = {KMgH3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one magnesium molecule and one KH3 framework. In the KH3 framework, K1+ is bonded to six equivalent H1- atoms to form corner-sharing KH6 octahedra. The corner-sharing octahedral tilt angles are 0°. All K–H bond lengths are 2.22 Å. H1- is bonded in a linear geometry to two equivalent K1+ atoms.},

  doi          = {10.17188/1349817},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1349817

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