Materials Data on Ca2Mg by Materials Project

doi:10.17188/1654255

Title: Materials Data on Ca2Mg by Materials Project

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Abstract

Ca2Mg is Molybdenite structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is two-dimensional and consists of two Ca2Mg sheets oriented in the (0, 0, 1) direction. Ca is bonded to three equivalent Mg atoms to form a mixture of distorted corner and face-sharing CaMg3 cuboctahedra. All Ca–Mg bond lengths are 3.53 Å. Mg is bonded in a 6-coordinate geometry to six equivalent Ca atoms.

Publication Date:: 2020-05-03

Other Number(s):: mp-1039227

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; Ca-Mg; Ca2Mg; crystal structure

OSTI Identifier:: 1654255

DOI:: https://doi.org/10.17188/1654255

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                    Materials Data on Ca2Mg by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1654255.

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                    Materials Data on Ca2Mg by Materials Project.  United States.  doi:https://doi.org/10.17188/1654255

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                    2020.  
"Materials Data on Ca2Mg by Materials Project".  United States.  doi:https://doi.org/10.17188/1654255.  https://www.osti.gov/servlets/purl/1654255. Pub date:Sun May 03 04:00:00 UTC 2020

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@article{osti_1654255,

  title        = {Materials Data on Ca2Mg by Materials Project},

  
  abstractNote = {Ca2Mg is Molybdenite structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is two-dimensional and consists of two Ca2Mg sheets oriented in the (0, 0, 1) direction. Ca is bonded to three equivalent Mg atoms to form a mixture of distorted corner and face-sharing CaMg3 cuboctahedra. All Ca–Mg bond lengths are 3.53 Å. Mg is bonded in a 6-coordinate geometry to six equivalent Ca atoms.},

  doi          = {10.17188/1654255},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1654255

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Materials Data on Ca2Mg by Materials Project

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