Materials Data on HoAl by Materials Project

doi:10.17188/1662422

Title: Materials Data on HoAl by Materials Project

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Abstract

HoAl crystallizes in the orthorhombic Pbcm space group. The structure is three-dimensional. there are two inequivalent Ho sites. In the first Ho site, Ho is bonded in a 2-coordinate geometry to eight Al atoms. There are a spread of Ho–Al bond distances ranging from 3.05–3.38 Å. In the second Ho site, Ho is bonded in a 6-coordinate geometry to eight Al atoms. There are a spread of Ho–Al bond distances ranging from 3.05–3.53 Å. There are two inequivalent Al sites. In the first Al site, Al is bonded to eight Ho and four Al atoms to form a mixture of distorted corner, edge, and face-sharing AlHo8Al4 cuboctahedra. There are two shorter (2.72 Å) and two longer (2.81 Å) Al–Al bond lengths. In the second Al site, Al is bonded in a 10-coordinate geometry to eight Ho and two equivalent Al atoms.

Authors:: The Materials Project

Publication Date:: 2020-07-15

Other Number(s):: mp-1188420

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; HoAl; Al-Ho

OSTI Identifier:: 1662422

DOI:: https://doi.org/10.17188/1662422

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                    The Materials Project. Materials Data on HoAl by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1662422.

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                    The Materials Project. Materials Data on HoAl by Materials Project.  United States.  doi:https://doi.org/10.17188/1662422

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                    The Materials Project. 2020.  
"Materials Data on HoAl by Materials Project".  United States.  doi:https://doi.org/10.17188/1662422.  https://www.osti.gov/servlets/purl/1662422. Pub date:Wed Jul 15 00:00:00 EDT 2020

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@article{osti_1662422,

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

  author       = {The Materials Project},

  abstractNote = {HoAl crystallizes in the orthorhombic Pbcm space group. The structure is three-dimensional. there are two inequivalent Ho sites. In the first Ho site, Ho is bonded in a 2-coordinate geometry to eight Al atoms. There are a spread of Ho–Al bond distances ranging from 3.05–3.38 Å. In the second Ho site, Ho is bonded in a 6-coordinate geometry to eight Al atoms. There are a spread of Ho–Al bond distances ranging from 3.05–3.53 Å. There are two inequivalent Al sites. In the first Al site, Al is bonded to eight Ho and four Al atoms to form a mixture of distorted corner, edge, and face-sharing AlHo8Al4 cuboctahedra. There are two shorter (2.72 Å) and two longer (2.81 Å) Al–Al bond lengths. In the second Al site, Al is bonded in a 10-coordinate geometry to eight Ho and two equivalent Al atoms.},

  doi          = {10.17188/1662422},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1662422

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