Materials Data on NdMgGa by Materials Project

doi:10.17188/1187598

Title: Materials Data on NdMgGa by Materials Project

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Abstract

MgNdGa crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Mg is bonded to four Ga atoms to form a mixture of distorted edge and corner-sharing MgGa4 tetrahedra. There are two shorter (2.89 Å) and two longer (2.91 Å) Mg–Ga bond lengths. Nd is bonded in a 5-coordinate geometry to five Ga atoms. There are one shorter (3.16 Å) and four longer (3.19 Å) Nd–Ga bond lengths. There are two inequivalent Ga sites. In the first Ga site, Ga is bonded in a 9-coordinate geometry to six equivalent Mg and three equivalent Nd atoms. In the second Ga site, Ga is bonded in a 9-coordinate geometry to three equivalent Mg and six equivalent Nd atoms.

Authors:: The Materials Project

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

Other Number(s):: mp-11155

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; NdMgGa; Ga-Mg-Nd

OSTI Identifier:: 1187598

DOI:: https://doi.org/10.17188/1187598

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                    The Materials Project. Materials Data on NdMgGa by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1187598.

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                    The Materials Project. Materials Data on NdMgGa by Materials Project.  United States.  doi:https://doi.org/10.17188/1187598

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                    The Materials Project. 2020.  
"Materials Data on NdMgGa by Materials Project".  United States.  doi:https://doi.org/10.17188/1187598.  https://www.osti.gov/servlets/purl/1187598. Pub date:Thu Jul 16 00:00:00 EDT 2020

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@article{osti_1187598,

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

  author       = {The Materials Project},

  abstractNote = {MgNdGa crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Mg is bonded to four Ga atoms to form a mixture of distorted edge and corner-sharing MgGa4 tetrahedra. There are two shorter (2.89 Å) and two longer (2.91 Å) Mg–Ga bond lengths. Nd is bonded in a 5-coordinate geometry to five Ga atoms. There are one shorter (3.16 Å) and four longer (3.19 Å) Nd–Ga bond lengths. There are two inequivalent Ga sites. In the first Ga site, Ga is bonded in a 9-coordinate geometry to six equivalent Mg and three equivalent Nd atoms. In the second Ga site, Ga is bonded in a 9-coordinate geometry to three equivalent Mg and six equivalent Nd atoms.},

  doi          = {10.17188/1187598},

  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/10.17188/1187598

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