Materials Data on Mo3P by Materials Project

doi:10.17188/1184817

Title: Materials Data on Mo3P by Materials Project

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Abstract

Mo3P crystallizes in the tetragonal I-42m space group. The structure is three-dimensional. there are three inequivalent Mo sites. In the first Mo site, Mo is bonded in a 3-coordinate geometry to twelve Mo and two equivalent P atoms. There are a spread of Mo–Mo bond distances ranging from 2.58–3.16 Å. Both Mo–P bond lengths are 2.52 Å. In the second Mo site, Mo is bonded in a 4-coordinate geometry to two equivalent Mo and four equivalent P atoms. All Mo–P bond lengths are 2.50 Å. In the third Mo site, Mo is bonded in a 2-coordinate geometry to five equivalent Mo and two equivalent P atoms. Both Mo–P bond lengths are 2.45 Å. P is bonded in a 8-coordinate geometry to eight Mo atoms.

Authors:: The Materials Project

Publication Date:: Sat May 02 00:00:00 EDT 2020

Other Number(s):: mp-10004

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; Mo3P; Mo-P

OSTI Identifier:: 1184817

DOI:: https://doi.org/10.17188/1184817

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                    The Materials Project. Materials Data on Mo3P by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1184817.

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                    The Materials Project. Materials Data on Mo3P by Materials Project.  United States.  doi:https://doi.org/10.17188/1184817

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                    The Materials Project. 2020.  
"Materials Data on Mo3P by Materials Project".  United States.  doi:https://doi.org/10.17188/1184817.  https://www.osti.gov/servlets/purl/1184817. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1184817,

  title        = {Materials Data on Mo3P by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Mo3P crystallizes in the tetragonal I-42m space group. The structure is three-dimensional. there are three inequivalent Mo sites. In the first Mo site, Mo is bonded in a 3-coordinate geometry to twelve Mo and two equivalent P atoms. There are a spread of Mo–Mo bond distances ranging from 2.58–3.16 Å. Both Mo–P bond lengths are 2.52 Å. In the second Mo site, Mo is bonded in a 4-coordinate geometry to two equivalent Mo and four equivalent P atoms. All Mo–P bond lengths are 2.50 Å. In the third Mo site, Mo is bonded in a 2-coordinate geometry to five equivalent Mo and two equivalent P atoms. Both Mo–P bond lengths are 2.45 Å. P is bonded in a 8-coordinate geometry to eight Mo atoms.},

  doi          = {10.17188/1184817},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat May 02 00:00:00 EDT 2020},

  month        = {Sat May 02 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1184817

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