Materials Data on Sm3Ho by Materials Project

doi:10.17188/1316158

Title: Materials Data on Sm3Ho by Materials Project

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Abstract

HoSm3 is beta Cu3Ti-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Ho is bonded to twelve equivalent Sm atoms to form HoSm12 cuboctahedra that share corners with six equivalent HoSm12 cuboctahedra, corners with twelve equivalent SmSm8Ho4 cuboctahedra, edges with eighteen equivalent SmSm8Ho4 cuboctahedra, faces with eight equivalent HoSm12 cuboctahedra, and faces with twelve equivalent SmSm8Ho4 cuboctahedra. There are six shorter (3.58 Å) and six longer (3.65 Å) Ho–Sm bond lengths. Sm is bonded to four equivalent Ho and eight equivalent Sm atoms to form SmSm8Ho4 cuboctahedra that share corners with four equivalent HoSm12 cuboctahedra, corners with fourteen equivalent SmSm8Ho4 cuboctahedra, edges with six equivalent HoSm12 cuboctahedra, edges with twelve equivalent SmSm8Ho4 cuboctahedra, faces with four equivalent HoSm12 cuboctahedra, and faces with sixteen equivalent SmSm8Ho4 cuboctahedra. There are a spread of Sm–Sm bond distances ranging from 3.58–3.65 Å.

Authors:: The Materials Project

Publication Date:: 2020-07-18

Other Number(s):: mp-979899

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; Sm3Ho; Ho-Sm

OSTI Identifier:: 1316158

DOI:: https://doi.org/10.17188/1316158

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                    The Materials Project. Materials Data on Sm3Ho by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1316158.

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                    The Materials Project. Materials Data on Sm3Ho by Materials Project.  United States.  doi:https://doi.org/10.17188/1316158

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                    The Materials Project. 2020.  
"Materials Data on Sm3Ho by Materials Project".  United States.  doi:https://doi.org/10.17188/1316158.  https://www.osti.gov/servlets/purl/1316158. Pub date:Sat Jul 18 00:00:00 EDT 2020

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@article{osti_1316158,

  title        = {Materials Data on Sm3Ho by Materials Project},

  author       = {The Materials Project},

  abstractNote = {HoSm3 is beta Cu3Ti-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Ho is bonded to twelve equivalent Sm atoms to form HoSm12 cuboctahedra that share corners with six equivalent HoSm12 cuboctahedra, corners with twelve equivalent SmSm8Ho4 cuboctahedra, edges with eighteen equivalent SmSm8Ho4 cuboctahedra, faces with eight equivalent HoSm12 cuboctahedra, and faces with twelve equivalent SmSm8Ho4 cuboctahedra. There are six shorter (3.58 Å) and six longer (3.65 Å) Ho–Sm bond lengths. Sm is bonded to four equivalent Ho and eight equivalent Sm atoms to form SmSm8Ho4 cuboctahedra that share corners with four equivalent HoSm12 cuboctahedra, corners with fourteen equivalent SmSm8Ho4 cuboctahedra, edges with six equivalent HoSm12 cuboctahedra, edges with twelve equivalent SmSm8Ho4 cuboctahedra, faces with four equivalent HoSm12 cuboctahedra, and faces with sixteen equivalent SmSm8Ho4 cuboctahedra. There are a spread of Sm–Sm bond distances ranging from 3.58–3.65 Å.},

  doi          = {10.17188/1316158},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1316158

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