Materials Data on CeMg3 by Materials Project

doi:10.17188/1662941

Title: Materials Data on CeMg3 by Materials Project

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Abstract

Mg3Ce crystallizes in the orthorhombic Imm2 space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded in a 12-coordinate geometry to six Mg and four equivalent Ce atoms. There are two shorter (3.18 Å) and four longer (3.37 Å) Mg–Mg bond lengths. There are two shorter (3.38 Å) and two longer (3.42 Å) Mg–Ce bond lengths. In the second Mg site, Mg is bonded in a 12-coordinate geometry to eight Mg and three equivalent Ce atoms. There are two shorter (3.18 Å) and four longer (3.40 Å) Mg–Mg bond lengths. There are one shorter (3.46 Å) and two longer (3.48 Å) Mg–Ce bond lengths. Ce is bonded to ten Mg and two equivalent Ce atoms to form a mixture of face, edge, and corner-sharing CeCe2Mg10 cuboctahedra. Both Ce–Ce bond lengths are 3.18 Å.

Authors:: The Materials Project

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

Other Number(s):: mp-1094814

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; CeMg3; Ce-Mg

OSTI Identifier:: 1662941

DOI:: https://doi.org/10.17188/1662941

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                    The Materials Project. Materials Data on CeMg3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1662941.

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                    The Materials Project. Materials Data on CeMg3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1662941

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                    The Materials Project. 2020.  
"Materials Data on CeMg3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1662941.  https://www.osti.gov/servlets/purl/1662941. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1662941,

  title        = {Materials Data on CeMg3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Mg3Ce crystallizes in the orthorhombic Imm2 space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded in a 12-coordinate geometry to six Mg and four equivalent Ce atoms. There are two shorter (3.18 Å) and four longer (3.37 Å) Mg–Mg bond lengths. There are two shorter (3.38 Å) and two longer (3.42 Å) Mg–Ce bond lengths. In the second Mg site, Mg is bonded in a 12-coordinate geometry to eight Mg and three equivalent Ce atoms. There are two shorter (3.18 Å) and four longer (3.40 Å) Mg–Mg bond lengths. There are one shorter (3.46 Å) and two longer (3.48 Å) Mg–Ce bond lengths. Ce is bonded to ten Mg and two equivalent Ce atoms to form a mixture of face, edge, and corner-sharing CeCe2Mg10 cuboctahedra. Both Ce–Ce bond lengths are 3.18 Å.},

  doi          = {10.17188/1662941},

  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/10.17188/1662941

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