Materials Data on Ho3Sc by Materials Project

doi:10.17188/1662772

Title: Materials Data on Ho3Sc by Materials Project

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Abstract

Ho3Sc is beta Cu3Ti-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Ho is bonded to eight equivalent Ho and four equivalent Sc atoms to form HoHo8Sc4 cuboctahedra that share corners with four equivalent ScHo12 cuboctahedra, corners with fourteen equivalent HoHo8Sc4 cuboctahedra, edges with six equivalent ScHo12 cuboctahedra, edges with twelve equivalent HoHo8Sc4 cuboctahedra, faces with four equivalent ScHo12 cuboctahedra, and faces with sixteen equivalent HoHo8Sc4 cuboctahedra. There are a spread of Ho–Ho bond distances ranging from 3.45–3.58 Å. There are two shorter (3.41 Å) and two longer (3.53 Å) Ho–Sc bond lengths. Sc is bonded to twelve equivalent Ho atoms to form ScHo12 cuboctahedra that share corners with six equivalent ScHo12 cuboctahedra, corners with twelve equivalent HoHo8Sc4 cuboctahedra, edges with eighteen equivalent HoHo8Sc4 cuboctahedra, faces with eight equivalent ScHo12 cuboctahedra, and faces with twelve equivalent HoHo8Sc4 cuboctahedra.

Authors:: The Materials Project

Publication Date:: Wed Jul 22 00:00:00 EDT 2020

Other Number(s):: mp-1184707

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; Ho3Sc; Ho-Sc

OSTI Identifier:: 1662772

DOI:: https://doi.org/10.17188/1662772

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                    The Materials Project. Materials Data on Ho3Sc by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1662772.

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                    The Materials Project. Materials Data on Ho3Sc by Materials Project.  United States.  doi:https://doi.org/10.17188/1662772

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                    The Materials Project. 2020.  
"Materials Data on Ho3Sc by Materials Project".  United States.  doi:https://doi.org/10.17188/1662772.  https://www.osti.gov/servlets/purl/1662772. Pub date:Wed Jul 22 00:00:00 EDT 2020

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@article{osti_1662772,

  title        = {Materials Data on Ho3Sc by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Ho3Sc is beta Cu3Ti-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Ho is bonded to eight equivalent Ho and four equivalent Sc atoms to form HoHo8Sc4 cuboctahedra that share corners with four equivalent ScHo12 cuboctahedra, corners with fourteen equivalent HoHo8Sc4 cuboctahedra, edges with six equivalent ScHo12 cuboctahedra, edges with twelve equivalent HoHo8Sc4 cuboctahedra, faces with four equivalent ScHo12 cuboctahedra, and faces with sixteen equivalent HoHo8Sc4 cuboctahedra. There are a spread of Ho–Ho bond distances ranging from 3.45–3.58 Å. There are two shorter (3.41 Å) and two longer (3.53 Å) Ho–Sc bond lengths. Sc is bonded to twelve equivalent Ho atoms to form ScHo12 cuboctahedra that share corners with six equivalent ScHo12 cuboctahedra, corners with twelve equivalent HoHo8Sc4 cuboctahedra, edges with eighteen equivalent HoHo8Sc4 cuboctahedra, faces with eight equivalent ScHo12 cuboctahedra, and faces with twelve equivalent HoHo8Sc4 cuboctahedra.},

  doi          = {10.17188/1662772},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Wed Jul 22 00:00:00 EDT 2020},

  month        = {Wed Jul 22 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1662772

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