Materials Data on Gd3AlC by Materials Project

doi:10.17188/1276777

Title: Materials Data on Gd3AlC by Materials Project

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Abstract

Gd3AlC is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Gd is bonded in a linear geometry to four equivalent Al and two equivalent C atoms. All Gd–Al bond lengths are 3.49 Å. Both Gd–C bond lengths are 2.47 Å. Al is bonded to twelve equivalent Gd atoms to form AlGd12 cuboctahedra that share corners with twelve equivalent AlGd12 cuboctahedra, faces with six equivalent AlGd12 cuboctahedra, and faces with eight equivalent CGd6 octahedra. C is bonded to six equivalent Gd atoms to form CGd6 octahedra that share corners with six equivalent CGd6 octahedra and faces with eight equivalent AlGd12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.

Authors:: The Materials Project

Publication Date:: 2020-07-17

Other Number(s):: mp-580539

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; Gd3AlC; Al-C-Gd

OSTI Identifier:: 1276777

DOI:: https://doi.org/10.17188/1276777

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                    The Materials Project. Materials Data on Gd3AlC by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1276777.

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                    The Materials Project. Materials Data on Gd3AlC by Materials Project.  United States.  doi:https://doi.org/10.17188/1276777

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                    The Materials Project. 2020.  
"Materials Data on Gd3AlC by Materials Project".  United States.  doi:https://doi.org/10.17188/1276777.  https://www.osti.gov/servlets/purl/1276777. Pub date:Fri Jul 17 00:00:00 EDT 2020

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@article{osti_1276777,

  title        = {Materials Data on Gd3AlC by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Gd3AlC is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Gd is bonded in a linear geometry to four equivalent Al and two equivalent C atoms. All Gd–Al bond lengths are 3.49 Å. Both Gd–C bond lengths are 2.47 Å. Al is bonded to twelve equivalent Gd atoms to form AlGd12 cuboctahedra that share corners with twelve equivalent AlGd12 cuboctahedra, faces with six equivalent AlGd12 cuboctahedra, and faces with eight equivalent CGd6 octahedra. C is bonded to six equivalent Gd atoms to form CGd6 octahedra that share corners with six equivalent CGd6 octahedra and faces with eight equivalent AlGd12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.},

  doi          = {10.17188/1276777},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1276777

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