Materials Data on PrFeGe2 by Materials Project

doi:10.17188/1315831

Title: Materials Data on PrFeGe2 by Materials Project

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Abstract

PrFeGe2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Pr is bonded in a 10-coordinate geometry to five equivalent Fe and ten Ge atoms. There are four shorter (3.35 Å) and one longer (3.41 Å) Pr–Fe bond lengths. There are a spread of Pr–Ge bond distances ranging from 3.19–3.31 Å. Fe is bonded in a 5-coordinate geometry to five equivalent Pr and five Ge atoms. There are a spread of Fe–Ge bond distances ranging from 2.32–2.41 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 1-coordinate geometry to six equivalent Pr, one Fe, and two equivalent Ge atoms. Both Ge–Ge bond lengths are 2.65 Å. In the second Ge site, Ge is bonded in a 8-coordinate geometry to four equivalent Pr and four equivalent Fe atoms.

Authors:: The Materials Project

Publication Date:: 2017-07-21

Other Number(s):: mp-978101

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; PrFeGe2; Fe-Ge-Pr

OSTI Identifier:: 1315831

DOI:: https://doi.org/10.17188/1315831

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                    The Materials Project. Materials Data on PrFeGe2 by Materials Project.  United States: N. p., 2017. 
        Web.  doi:10.17188/1315831.

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                    The Materials Project. Materials Data on PrFeGe2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1315831

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                    The Materials Project. 2017.  
"Materials Data on PrFeGe2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1315831.  https://www.osti.gov/servlets/purl/1315831. Pub date:Fri Jul 21 00:00:00 EDT 2017

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@article{osti_1315831,

  title        = {Materials Data on PrFeGe2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {PrFeGe2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Pr is bonded in a 10-coordinate geometry to five equivalent Fe and ten Ge atoms. There are four shorter (3.35 Å) and one longer (3.41 Å) Pr–Fe bond lengths. There are a spread of Pr–Ge bond distances ranging from 3.19–3.31 Å. Fe is bonded in a 5-coordinate geometry to five equivalent Pr and five Ge atoms. There are a spread of Fe–Ge bond distances ranging from 2.32–2.41 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 1-coordinate geometry to six equivalent Pr, one Fe, and two equivalent Ge atoms. Both Ge–Ge bond lengths are 2.65 Å. In the second Ge site, Ge is bonded in a 8-coordinate geometry to four equivalent Pr and four equivalent Fe atoms.},

  doi          = {10.17188/1315831},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2017},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1315831

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