Materials Data on NbCoP by Materials Project

doi:10.17188/1196905

Title: Materials Data on NbCoP by Materials Project

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Abstract

NbCoP crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Nb2+ is bonded to five equivalent P3- atoms to form distorted NbP5 trigonal bipyramids that share corners with eight equivalent CoP4 tetrahedra, corners with eight equivalent NbP5 trigonal bipyramids, edges with six equivalent CoP4 tetrahedra, and edges with six equivalent NbP5 trigonal bipyramids. There are a spread of Nb–P bond distances ranging from 2.56–2.62 Å. Co1+ is bonded to four equivalent P3- atoms to form CoP4 tetrahedra that share corners with eight equivalent CoP4 tetrahedra, corners with eight equivalent NbP5 trigonal bipyramids, edges with two equivalent CoP4 tetrahedra, and edges with six equivalent NbP5 trigonal bipyramids. There are a spread of Co–P bond distances ranging from 2.25–2.36 Å. P3- is bonded in a 9-coordinate geometry to five equivalent Nb2+ and four equivalent Co1+ atoms.

Authors:: The Materials Project

Publication Date:: Wed May 10 00:00:00 EDT 2017

Other Number(s):: mp-21449

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; NbCoP; Co-Nb-P

OSTI Identifier:: 1196905

DOI:: https://doi.org/10.17188/1196905

Citation Formats


                    The Materials Project. Materials Data on NbCoP by Materials Project.  United States: N. p., 2017. 
        Web.  doi:10.17188/1196905.

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                    The Materials Project. Materials Data on NbCoP by Materials Project.  United States.  doi:https://doi.org/10.17188/1196905

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                    The Materials Project. 2017.  
"Materials Data on NbCoP by Materials Project".  United States.  doi:https://doi.org/10.17188/1196905.  https://www.osti.gov/servlets/purl/1196905. Pub date:Wed May 10 00:00:00 EDT 2017

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@article{osti_1196905,

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

  author       = {The Materials Project},

  abstractNote = {NbCoP crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Nb2+ is bonded to five equivalent P3- atoms to form distorted NbP5 trigonal bipyramids that share corners with eight equivalent CoP4 tetrahedra, corners with eight equivalent NbP5 trigonal bipyramids, edges with six equivalent CoP4 tetrahedra, and edges with six equivalent NbP5 trigonal bipyramids. There are a spread of Nb–P bond distances ranging from 2.56–2.62 Å. Co1+ is bonded to four equivalent P3- atoms to form CoP4 tetrahedra that share corners with eight equivalent CoP4 tetrahedra, corners with eight equivalent NbP5 trigonal bipyramids, edges with two equivalent CoP4 tetrahedra, and edges with six equivalent NbP5 trigonal bipyramids. There are a spread of Co–P bond distances ranging from 2.25–2.36 Å. P3- is bonded in a 9-coordinate geometry to five equivalent Nb2+ and four equivalent Co1+ atoms.},

  doi          = {10.17188/1196905},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Wed May 10 00:00:00 EDT 2017},

  month        = {Wed May 10 00:00:00 EDT 2017}

}

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DOI: https://doi.org/10.17188/1196905

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