Materials Data on HfCuP by Materials Project

doi:10.17188/1275379

Title: Materials Data on HfCuP by Materials Project

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Abstract

HfCuP is Ilmenite-like structured and crystallizes in the trigonal P3m1 space group. The structure is three-dimensional. Hf is bonded in a 6-coordinate geometry to three equivalent Cu and three equivalent P atoms. All Hf–Cu bond lengths are 2.83 Å. All Hf–P bond lengths are 2.50 Å. Cu is bonded in a 4-coordinate geometry to three equivalent Hf and one P atom. The Cu–P bond length is 2.25 Å. P is bonded in a rectangular see-saw-like geometry to three equivalent Hf and one Cu atom.

Authors:: The Materials Project

Publication Date:: 2020-07-23

Other Number(s):: mp-569933

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; HfCuP; Cu-Hf-P

OSTI Identifier:: 1275379

DOI:: https://doi.org/10.17188/1275379

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                    The Materials Project. Materials Data on HfCuP by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1275379.

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                    The Materials Project. Materials Data on HfCuP by Materials Project.  United States.  doi:https://doi.org/10.17188/1275379

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                    The Materials Project. 2020.  
"Materials Data on HfCuP by Materials Project".  United States.  doi:https://doi.org/10.17188/1275379.  https://www.osti.gov/servlets/purl/1275379. Pub date:Thu Jul 23 00:00:00 EDT 2020

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@article{osti_1275379,

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

  author       = {The Materials Project},

  abstractNote = {HfCuP is Ilmenite-like structured and crystallizes in the trigonal P3m1 space group. The structure is three-dimensional. Hf is bonded in a 6-coordinate geometry to three equivalent Cu and three equivalent P atoms. All Hf–Cu bond lengths are 2.83 Å. All Hf–P bond lengths are 2.50 Å. Cu is bonded in a 4-coordinate geometry to three equivalent Hf and one P atom. The Cu–P bond length is 2.25 Å. P is bonded in a rectangular see-saw-like geometry to three equivalent Hf and one Cu atom.},

  doi          = {10.17188/1275379},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1275379

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