Materials Data on CdIn3 by Materials Project

doi:10.17188/1744953

Title: Materials Data on CdIn3 by Materials Project

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Abstract

CdIn3 crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Cd is bonded to twelve equivalent In atoms to form CdIn12 cuboctahedra that share corners with six equivalent CdIn12 cuboctahedra, corners with twelve equivalent InCd4In8 cuboctahedra, edges with eighteen equivalent InCd4In8 cuboctahedra, faces with eight equivalent CdIn12 cuboctahedra, and faces with twelve equivalent InCd4In8 cuboctahedra. There are six shorter (3.25 Å) and six longer (3.49 Å) Cd–In bond lengths. In is bonded to four equivalent Cd and eight equivalent In atoms to form distorted InCd4In8 cuboctahedra that share corners with four equivalent CdIn12 cuboctahedra, corners with fourteen equivalent InCd4In8 cuboctahedra, edges with six equivalent CdIn12 cuboctahedra, edges with twelve equivalent InCd4In8 cuboctahedra, faces with four equivalent CdIn12 cuboctahedra, and faces with sixteen equivalent InCd4In8 cuboctahedra. There are a spread of In–In bond distances ranging from 3.22–3.51 Å.

Authors:: The Materials Project

Publication Date:: 2020-05-03

Other Number(s):: mp-1183676

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; CdIn3; Cd-In

OSTI Identifier:: 1744953

DOI:: https://doi.org/10.17188/1744953

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                    The Materials Project. Materials Data on CdIn3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1744953.

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                    The Materials Project. Materials Data on CdIn3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1744953

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                    The Materials Project. 2020.  
"Materials Data on CdIn3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1744953.  https://www.osti.gov/servlets/purl/1744953. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1744953,

  title        = {Materials Data on CdIn3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {CdIn3 crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Cd is bonded to twelve equivalent In atoms to form CdIn12 cuboctahedra that share corners with six equivalent CdIn12 cuboctahedra, corners with twelve equivalent InCd4In8 cuboctahedra, edges with eighteen equivalent InCd4In8 cuboctahedra, faces with eight equivalent CdIn12 cuboctahedra, and faces with twelve equivalent InCd4In8 cuboctahedra. There are six shorter (3.25 Å) and six longer (3.49 Å) Cd–In bond lengths. In is bonded to four equivalent Cd and eight equivalent In atoms to form distorted InCd4In8 cuboctahedra that share corners with four equivalent CdIn12 cuboctahedra, corners with fourteen equivalent InCd4In8 cuboctahedra, edges with six equivalent CdIn12 cuboctahedra, edges with twelve equivalent InCd4In8 cuboctahedra, faces with four equivalent CdIn12 cuboctahedra, and faces with sixteen equivalent InCd4In8 cuboctahedra. There are a spread of In–In bond distances ranging from 3.22–3.51 Å.},

  doi          = {10.17188/1744953},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1744953

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