Materials Data on Lu2Al3Co by Materials Project

doi:10.17188/1191901

Title: Materials Data on Lu2Al3Co by Materials Project

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Abstract

Lu2CoAl3 crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Lu is bonded in a 12-coordinate geometry to four equivalent Lu, three equivalent Co, and nine equivalent Al atoms. There are three shorter (3.28 Å) and one longer (3.30 Å) Lu–Lu bond lengths. All Lu–Co bond lengths are 3.18 Å. There are three shorter (3.05 Å) and six longer (3.18 Å) Lu–Al bond lengths. Co is bonded to six equivalent Lu and six equivalent Al atoms to form CoLu6Al6 cuboctahedra that share corners with twelve equivalent AlLu6Al4Co2 cuboctahedra, edges with six equivalent CoLu6Al6 cuboctahedra, faces with two equivalent CoLu6Al6 cuboctahedra, and faces with eighteen equivalent AlLu6Al4Co2 cuboctahedra. All Co–Al bond lengths are 2.62 Å. Al is bonded to six equivalent Lu, two equivalent Co, and four equivalent Al atoms to form distorted AlLu6Al4Co2 cuboctahedra that share corners with four equivalent CoLu6Al6 cuboctahedra, corners with fourteen equivalent AlLu6Al4Co2 cuboctahedra, edges with six equivalent AlLu6Al4Co2 cuboctahedra, faces with six equivalent CoLu6Al6 cuboctahedra, and faces with twelve equivalent AlLu6Al4Co2 cuboctahedra. There are two shorter (2.65 Å) and two longer (2.79 Å) Al–Al bond lengths.

Authors:: The Materials Project

Publication Date:: Wed Jul 15 00:00:00 EDT 2020

Other Number(s):: mp-16490

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; Lu2Al3Co; Al-Co-Lu

OSTI Identifier:: 1191901

DOI:: https://doi.org/10.17188/1191901

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                    The Materials Project. Materials Data on Lu2Al3Co by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1191901.

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                    The Materials Project. Materials Data on Lu2Al3Co by Materials Project.  United States.  doi:https://doi.org/10.17188/1191901

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                    The Materials Project. 2020.  
"Materials Data on Lu2Al3Co by Materials Project".  United States.  doi:https://doi.org/10.17188/1191901.  https://www.osti.gov/servlets/purl/1191901. Pub date:Wed Jul 15 00:00:00 EDT 2020

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@article{osti_1191901,

  title        = {Materials Data on Lu2Al3Co by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Lu2CoAl3 crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Lu is bonded in a 12-coordinate geometry to four equivalent Lu, three equivalent Co, and nine equivalent Al atoms. There are three shorter (3.28 Å) and one longer (3.30 Å) Lu–Lu bond lengths. All Lu–Co bond lengths are 3.18 Å. There are three shorter (3.05 Å) and six longer (3.18 Å) Lu–Al bond lengths. Co is bonded to six equivalent Lu and six equivalent Al atoms to form CoLu6Al6 cuboctahedra that share corners with twelve equivalent AlLu6Al4Co2 cuboctahedra, edges with six equivalent CoLu6Al6 cuboctahedra, faces with two equivalent CoLu6Al6 cuboctahedra, and faces with eighteen equivalent AlLu6Al4Co2 cuboctahedra. All Co–Al bond lengths are 2.62 Å. Al is bonded to six equivalent Lu, two equivalent Co, and four equivalent Al atoms to form distorted AlLu6Al4Co2 cuboctahedra that share corners with four equivalent CoLu6Al6 cuboctahedra, corners with fourteen equivalent AlLu6Al4Co2 cuboctahedra, edges with six equivalent AlLu6Al4Co2 cuboctahedra, faces with six equivalent CoLu6Al6 cuboctahedra, and faces with twelve equivalent AlLu6Al4Co2 cuboctahedra. There are two shorter (2.65 Å) and two longer (2.79 Å) Al–Al bond lengths.},

  doi          = {10.17188/1191901},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Wed Jul 15 00:00:00 EDT 2020},

  month        = {Wed Jul 15 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1191901

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