Materials Data on Nd3Co by Materials Project

doi:10.17188/1687607

Title: Materials Data on Nd3Co by Materials Project

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Abstract

Nd3Co is Cementite structured and crystallizes in the orthorhombic Pnma space group. The structure is two-dimensional and consists of two Nd3Co sheets oriented in the (0, 0, 1) direction. there are two inequivalent Nd sites. In the first Nd site, Nd is bonded in a distorted bent 150 degrees geometry to two equivalent Co atoms. There are one shorter (2.77 Å) and one longer (2.91 Å) Nd–Co bond lengths. In the second Nd site, Nd is bonded in a distorted water-like geometry to two equivalent Co atoms. There are one shorter (2.78 Å) and one longer (2.89 Å) Nd–Co bond lengths. Co is bonded in a 6-coordinate geometry to six Nd atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-03

Other Number(s):: mp-1106011

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; Nd3Co; Co-Nd

OSTI Identifier:: 1687607

DOI:: https://doi.org/10.17188/1687607

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                    The Materials Project. Materials Data on Nd3Co by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1687607.

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                    The Materials Project. Materials Data on Nd3Co by Materials Project.  United States.  doi:https://doi.org/10.17188/1687607

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                    The Materials Project. 2020.  
"Materials Data on Nd3Co by Materials Project".  United States.  doi:https://doi.org/10.17188/1687607.  https://www.osti.gov/servlets/purl/1687607. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1687607,

  title        = {Materials Data on Nd3Co by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Nd3Co is Cementite structured and crystallizes in the orthorhombic Pnma space group. The structure is two-dimensional and consists of two Nd3Co sheets oriented in the (0, 0, 1) direction. there are two inequivalent Nd sites. In the first Nd site, Nd is bonded in a distorted bent 150 degrees geometry to two equivalent Co atoms. There are one shorter (2.77 Å) and one longer (2.91 Å) Nd–Co bond lengths. In the second Nd site, Nd is bonded in a distorted water-like geometry to two equivalent Co atoms. There are one shorter (2.78 Å) and one longer (2.89 Å) Nd–Co bond lengths. Co is bonded in a 6-coordinate geometry to six Nd atoms.},

  doi          = {10.17188/1687607},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1687607

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