Materials Data on Nd3Al by Materials Project

doi:10.17188/1695833

Title: Materials Data on Nd3Al by Materials Project

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Abstract

Nd3Al is beta Cu3Ti-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Nd is bonded in a 12-coordinate geometry to eight equivalent Nd and four equivalent Al atoms. There are a spread of Nd–Nd bond distances ranging from 3.30–3.79 Å. There are two shorter (3.32 Å) and two longer (3.55 Å) Nd–Al bond lengths. Al is bonded to twelve equivalent Nd atoms to form a mixture of face and corner-sharing AlNd12 cuboctahedra.

Authors:: The Materials Project

Publication Date:: 2020-05-03

Other Number(s):: mp-1080098

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; Nd3Al; Al-Nd

OSTI Identifier:: 1695833

DOI:: https://doi.org/10.17188/1695833

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                    The Materials Project. Materials Data on Nd3Al by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1695833.

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                    The Materials Project. Materials Data on Nd3Al by Materials Project.  United States.  doi:https://doi.org/10.17188/1695833

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                    The Materials Project. 2020.  
"Materials Data on Nd3Al by Materials Project".  United States.  doi:https://doi.org/10.17188/1695833.  https://www.osti.gov/servlets/purl/1695833. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1695833,

  title        = {Materials Data on Nd3Al by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Nd3Al is beta Cu3Ti-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Nd is bonded in a 12-coordinate geometry to eight equivalent Nd and four equivalent Al atoms. There are a spread of Nd–Nd bond distances ranging from 3.30–3.79 Å. There are two shorter (3.32 Å) and two longer (3.55 Å) Nd–Al bond lengths. Al is bonded to twelve equivalent Nd atoms to form a mixture of face and corner-sharing AlNd12 cuboctahedra.},

  doi          = {10.17188/1695833},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1695833

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