Materials Data on Mg2C3 by Materials Project

doi:10.17188/1202848

Title: Materials Data on Mg2C3 by Materials Project

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Abstract

Mg2C3 crystallizes in the orthorhombic Pnnm space group. The structure is three-dimensional. Mg2+ is bonded in a 3-coordinate geometry to five C+1.33- atoms. There are a spread of Mg–C bond distances ranging from 2.21–2.47 Å. There are two inequivalent C+1.33- sites. In the first C+1.33- site, C+1.33- is bonded in a 2-coordinate geometry to two equivalent Mg2+ and two equivalent C+1.33- atoms. Both C–C bond lengths are 1.33 Å. In the second C+1.33- site, C+1.33- is bonded to four equivalent Mg2+ and one C+1.33- atom to form a mixture of distorted corner and edge-sharing CMg4C trigonal bipyramids.

Authors:: The Materials Project

Publication Date:: Thu Jul 16 00:00:00 EDT 2020

Other Number(s):: mp-28793

DOE Contract Number:: AC02-05CH11231; EDCBEE

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

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

Collaborations:: MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE

Keywords:: crystal structure; Mg2C3; C-Mg

OSTI Identifier:: 1202848

DOI:: https://doi.org/10.17188/1202848

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                    The Materials Project. Materials Data on Mg2C3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1202848.

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                    The Materials Project. Materials Data on Mg2C3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1202848

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                    The Materials Project. 2020.  
"Materials Data on Mg2C3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1202848.  https://www.osti.gov/servlets/purl/1202848. Pub date:Thu Jul 16 00:00:00 EDT 2020

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@article{osti_1202848,

  title        = {Materials Data on Mg2C3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Mg2C3 crystallizes in the orthorhombic Pnnm space group. The structure is three-dimensional. Mg2+ is bonded in a 3-coordinate geometry to five C+1.33- atoms. There are a spread of Mg–C bond distances ranging from 2.21–2.47 Å. There are two inequivalent C+1.33- sites. In the first C+1.33- site, C+1.33- is bonded in a 2-coordinate geometry to two equivalent Mg2+ and two equivalent C+1.33- atoms. Both C–C bond lengths are 1.33 Å. In the second C+1.33- site, C+1.33- is bonded to four equivalent Mg2+ and one C+1.33- atom to form a mixture of distorted corner and edge-sharing CMg4C trigonal bipyramids.},

  doi          = {10.17188/1202848},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Thu Jul 16 00:00:00 EDT 2020},

  month        = {Thu Jul 16 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1202848

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