Materials Data on NiF2 by Materials Project

doi:10.17188/1271049

Title: Materials Data on NiF2 by Materials Project

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Abstract

NiF2 is Rutile structured and crystallizes in the tetragonal P4_2/mnm space group. The structure is three-dimensional. Ni2+ is bonded to six equivalent F1- atoms to form a mixture of edge and corner-sharing NiF6 octahedra. The corner-sharing octahedral tilt angles are 50°. There are two shorter (2.02 Å) and four longer (2.03 Å) Ni–F bond lengths. F1- is bonded in a distorted trigonal planar geometry to three equivalent Ni2+ atoms.

Authors:: The Materials Project

Publication Date:: 2020-07-15

Other Number(s):: mp-559798

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; NiF2; F-Ni

OSTI Identifier:: 1271049

DOI:: https://doi.org/10.17188/1271049

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                    The Materials Project. Materials Data on NiF2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1271049.

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                    The Materials Project. Materials Data on NiF2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1271049

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                    The Materials Project. 2020.  
"Materials Data on NiF2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1271049.  https://www.osti.gov/servlets/purl/1271049. Pub date:Wed Jul 15 00:00:00 EDT 2020

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@article{osti_1271049,

  title        = {Materials Data on NiF2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {NiF2 is Rutile structured and crystallizes in the tetragonal P4_2/mnm space group. The structure is three-dimensional. Ni2+ is bonded to six equivalent F1- atoms to form a mixture of edge and corner-sharing NiF6 octahedra. The corner-sharing octahedral tilt angles are 50°. There are two shorter (2.02 Å) and four longer (2.03 Å) Ni–F bond lengths. F1- is bonded in a distorted trigonal planar geometry to three equivalent Ni2+ atoms.},

  doi          = {10.17188/1271049},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1271049

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