Materials Data on PdN2 by Materials Project

doi:10.17188/1717250

Title: Materials Data on PdN2 by Materials Project

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Abstract

PdN2 crystallizes in the cubic Pa-3 space group. The structure is three-dimensional. Pd2+ is bonded to six equivalent N1- atoms to form PdN6 octahedra that share corners with twelve equivalent PdN6 octahedra and corners with six equivalent NPd3N tetrahedra. The corner-sharing octahedral tilt angles are 74°. All Pd–N bond lengths are 2.27 Å. N1- is bonded to three equivalent Pd2+ and one N1- atom to form NPd3N tetrahedra that share corners with three equivalent PdN6 octahedra and corners with fifteen equivalent NPd3N tetrahedra. The corner-sharing octahedral tilt angles are 67°. The N–N bond length is 1.21 Å.

Authors:: The Materials Project

Publication Date:: 2020-05-03

Other Number(s):: mp-1103427

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; PdN2; N-Pd

OSTI Identifier:: 1717250

DOI:: https://doi.org/10.17188/1717250

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                    The Materials Project. Materials Data on PdN2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1717250.

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                    The Materials Project. Materials Data on PdN2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1717250

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                    The Materials Project. 2020.  
"Materials Data on PdN2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1717250.  https://www.osti.gov/servlets/purl/1717250. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1717250,

  title        = {Materials Data on PdN2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {PdN2 crystallizes in the cubic Pa-3 space group. The structure is three-dimensional. Pd2+ is bonded to six equivalent N1- atoms to form PdN6 octahedra that share corners with twelve equivalent PdN6 octahedra and corners with six equivalent NPd3N tetrahedra. The corner-sharing octahedral tilt angles are 74°. All Pd–N bond lengths are 2.27 Å. N1- is bonded to three equivalent Pd2+ and one N1- atom to form NPd3N tetrahedra that share corners with three equivalent PdN6 octahedra and corners with fifteen equivalent NPd3N tetrahedra. The corner-sharing octahedral tilt angles are 67°. The N–N bond length is 1.21 Å.},

  doi          = {10.17188/1717250},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1717250

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