Materials Data on FeMoP by Materials Project

doi:10.17188/1662853

Title: Materials Data on FeMoP by Materials Project

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Abstract

FeMoP crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Mo is bonded in a 11-coordinate geometry to six equivalent Fe and five equivalent P atoms. There are a spread of Mo–Fe bond distances ranging from 2.70–2.79 Å. There are a spread of Mo–P bond distances ranging from 2.44–2.60 Å. Fe is bonded to six equivalent Mo and four equivalent P atoms to form a mixture of distorted edge, face, and corner-sharing FeMo6P4 tetrahedra. There are one shorter (2.22 Å) and three longer (2.27 Å) Fe–P bond lengths. P is bonded in a 9-coordinate geometry to five equivalent Mo and four equivalent Fe atoms.

Authors:: The Materials Project

Publication Date:: 2020-07-17

Other Number(s):: mp-1102843

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; FeMoP; Fe-Mo-P

OSTI Identifier:: 1662853

DOI:: https://doi.org/10.17188/1662853

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                    The Materials Project. Materials Data on FeMoP by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1662853.

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                    The Materials Project. Materials Data on FeMoP by Materials Project.  United States.  doi:https://doi.org/10.17188/1662853

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                    The Materials Project. 2020.  
"Materials Data on FeMoP by Materials Project".  United States.  doi:https://doi.org/10.17188/1662853.  https://www.osti.gov/servlets/purl/1662853. Pub date:Fri Jul 17 00:00:00 EDT 2020

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@article{osti_1662853,

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

  author       = {The Materials Project},

  abstractNote = {FeMoP crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Mo is bonded in a 11-coordinate geometry to six equivalent Fe and five equivalent P atoms. There are a spread of Mo–Fe bond distances ranging from 2.70–2.79 Å. There are a spread of Mo–P bond distances ranging from 2.44–2.60 Å. Fe is bonded to six equivalent Mo and four equivalent P atoms to form a mixture of distorted edge, face, and corner-sharing FeMo6P4 tetrahedra. There are one shorter (2.22 Å) and three longer (2.27 Å) Fe–P bond lengths. P is bonded in a 9-coordinate geometry to five equivalent Mo and four equivalent Fe atoms.},

  doi          = {10.17188/1662853},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1662853

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