Materials Data on MgO by Materials Project

doi:10.17188/1304546

Title: Materials Data on MgO by Materials Project

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Abstract

MgO is Moissanite-4H structured and crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. there are two inequivalent Mg2+ sites. In the first Mg2+ site, Mg2+ is bonded to four O2- atoms to form corner-sharing MgO4 tetrahedra. There is one shorter (1.99 Å) and three longer (2.00 Å) Mg–O bond length. In the second Mg2+ site, Mg2+ is bonded to four O2- atoms to form corner-sharing MgO4 tetrahedra. There are three shorter (2.00 Å) and one longer (2.01 Å) Mg–O bond lengths. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to four Mg2+ atoms to form corner-sharing OMg4 tetrahedra. In the second O2- site, O2- is bonded to four Mg2+ atoms to form corner-sharing OMg4 tetrahedra.

Authors:: The Materials Project

Publication Date:: Sun May 03 00:00:00 EDT 2020

Other Number(s):: mp-776911

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; MgO; Mg-O

OSTI Identifier:: 1304546

DOI:: https://doi.org/10.17188/1304546

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                    The Materials Project. Materials Data on MgO by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1304546.

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                    The Materials Project. Materials Data on MgO by Materials Project.  United States.  doi:https://doi.org/10.17188/1304546

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                    The Materials Project. 2020.  
"Materials Data on MgO by Materials Project".  United States.  doi:https://doi.org/10.17188/1304546.  https://www.osti.gov/servlets/purl/1304546. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1304546,

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

  author       = {The Materials Project},

  abstractNote = {MgO is Moissanite-4H structured and crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. there are two inequivalent Mg2+ sites. In the first Mg2+ site, Mg2+ is bonded to four O2- atoms to form corner-sharing MgO4 tetrahedra. There is one shorter (1.99 Å) and three longer (2.00 Å) Mg–O bond length. In the second Mg2+ site, Mg2+ is bonded to four O2- atoms to form corner-sharing MgO4 tetrahedra. There are three shorter (2.00 Å) and one longer (2.01 Å) Mg–O bond lengths. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to four Mg2+ atoms to form corner-sharing OMg4 tetrahedra. In the second O2- site, O2- is bonded to four Mg2+ atoms to form corner-sharing OMg4 tetrahedra.},

  doi          = {10.17188/1304546},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sun May 03 00:00:00 EDT 2020},

  month        = {Sun May 03 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1304546

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