Materials Data on NbRh2 by Materials Project

doi:10.17188/1736371

Title: Materials Data on NbRh2 by Materials Project

Dataset

Abstract

NbRh2 crystallizes in the monoclinic P2/m space group. The structure is three-dimensional. Nb is bonded in a 12-coordinate geometry to nine Rh atoms. There are a spread of Nb–Rh bond distances ranging from 2.74–2.80 Å. There are three inequivalent Rh sites. In the first Rh site, Rh is bonded to six equivalent Nb atoms to form a mixture of distorted corner, edge, and face-sharing RhNb6 cuboctahedra. In the second Rh site, Rh is bonded to four equivalent Nb atoms to form a mixture of distorted corner and edge-sharing RhNb4 cuboctahedra. In the third Rh site, Rh is bonded in a distorted linear geometry to two equivalent Nb atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-02

Other Number(s):: mp-1220379

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; NbRh2; Nb-Rh

OSTI Identifier:: 1736371

DOI:: https://doi.org/10.17188/1736371

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                    The Materials Project. Materials Data on NbRh2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1736371.

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                    The Materials Project. Materials Data on NbRh2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1736371

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                    The Materials Project. 2020.  
"Materials Data on NbRh2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1736371.  https://www.osti.gov/servlets/purl/1736371. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1736371,

  title        = {Materials Data on NbRh2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {NbRh2 crystallizes in the monoclinic P2/m space group. The structure is three-dimensional. Nb is bonded in a 12-coordinate geometry to nine Rh atoms. There are a spread of Nb–Rh bond distances ranging from 2.74–2.80 Å. There are three inequivalent Rh sites. In the first Rh site, Rh is bonded to six equivalent Nb atoms to form a mixture of distorted corner, edge, and face-sharing RhNb6 cuboctahedra. In the second Rh site, Rh is bonded to four equivalent Nb atoms to form a mixture of distorted corner and edge-sharing RhNb4 cuboctahedra. In the third Rh site, Rh is bonded in a distorted linear geometry to two equivalent Nb atoms.},

  doi          = {10.17188/1736371},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1736371

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