Materials Data on Nd7Pd3 by Materials Project

doi:10.17188/1652333

Title: Materials Data on Nd7Pd3 by Materials Project

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Abstract

Nd7Pd3 crystallizes in the orthorhombic Cmc2_1 space group. The structure is three-dimensional. there are five inequivalent Nd sites. In the first Nd site, Nd is bonded in a 3-coordinate geometry to three Pd atoms. There are one shorter (2.98 Å) and two longer (2.99 Å) Nd–Pd bond lengths. In the second Nd site, Nd is bonded in a 3-coordinate geometry to three Pd atoms. There are two shorter (2.97 Å) and one longer (3.10 Å) Nd–Pd bond lengths. In the third Nd site, Nd is bonded in a 3-coordinate geometry to three Pd atoms. There are a spread of Nd–Pd bond distances ranging from 2.96–3.10 Å. In the fourth Nd site, Nd is bonded in a distorted water-like geometry to two equivalent Pd atoms. Both Nd–Pd bond lengths are 2.94 Å. In the fifth Nd site, Nd is bonded in a distorted water-like geometry to two Pd atoms. Both Nd–Pd bond lengths are 2.93 Å. There are two inequivalent Pd sites. In the first Pd site, Pd is bonded in a 6-coordinate geometry to six Nd atoms. In the second Pd site, Pd is bonded in a 6-coordinate geometry to six Nd atoms.

Authors:: The Materials Project

Publication Date:: 2018-07-19

Other Number(s):: mp-1106115

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; Nd7Pd3; Nd-Pd

OSTI Identifier:: 1652333

DOI:: https://doi.org/10.17188/1652333

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                    The Materials Project. Materials Data on Nd7Pd3 by Materials Project.  United States: N. p., 2018. 
        Web.  doi:10.17188/1652333.

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                    The Materials Project. Materials Data on Nd7Pd3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1652333

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                    The Materials Project. 2018.  
"Materials Data on Nd7Pd3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1652333.  https://www.osti.gov/servlets/purl/1652333. Pub date:Thu Jul 19 00:00:00 EDT 2018

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@article{osti_1652333,

  title        = {Materials Data on Nd7Pd3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Nd7Pd3 crystallizes in the orthorhombic Cmc2_1 space group. The structure is three-dimensional. there are five inequivalent Nd sites. In the first Nd site, Nd is bonded in a 3-coordinate geometry to three Pd atoms. There are one shorter (2.98 Å) and two longer (2.99 Å) Nd–Pd bond lengths. In the second Nd site, Nd is bonded in a 3-coordinate geometry to three Pd atoms. There are two shorter (2.97 Å) and one longer (3.10 Å) Nd–Pd bond lengths. In the third Nd site, Nd is bonded in a 3-coordinate geometry to three Pd atoms. There are a spread of Nd–Pd bond distances ranging from 2.96–3.10 Å. In the fourth Nd site, Nd is bonded in a distorted water-like geometry to two equivalent Pd atoms. Both Nd–Pd bond lengths are 2.94 Å. In the fifth Nd site, Nd is bonded in a distorted water-like geometry to two Pd atoms. Both Nd–Pd bond lengths are 2.93 Å. There are two inequivalent Pd sites. In the first Pd site, Pd is bonded in a 6-coordinate geometry to six Nd atoms. In the second Pd site, Pd is bonded in a 6-coordinate geometry to six Nd atoms.},

  doi          = {10.17188/1652333},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2018},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1652333

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