Materials Data on CeGa3Pd by Materials Project

doi:10.17188/1691018

Title: Materials Data on CeGa3Pd by Materials Project

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Abstract

CePdGa3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Ce is bonded in a 6-coordinate geometry to five equivalent Pd and twelve Ga atoms. There are a spread of Ce–Pd bond distances ranging from 3.29–3.66 Å. There are a spread of Ce–Ga bond distances ranging from 3.14–3.41 Å. Pd is bonded in a 5-coordinate geometry to five equivalent Ce and five Ga atoms. There are one shorter (2.47 Å) and four longer (2.54 Å) Pd–Ga bond lengths. There are two inequivalent Ga sites. In the first Ga site, Ga is bonded in a 1-coordinate geometry to four equivalent Ce, one Pd, and four equivalent Ga atoms. All Ga–Ga bond lengths are 2.65 Å. In the second Ga site, Ga is bonded in a distorted L-shaped geometry to four equivalent Ce, two equivalent Pd, and two equivalent Ga atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-03

Other Number(s):: mp-1078348

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; CeGa3Pd; Ce-Ga-Pd

OSTI Identifier:: 1691018

DOI:: https://doi.org/10.17188/1691018

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                    The Materials Project. Materials Data on CeGa3Pd by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1691018.

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                    The Materials Project. Materials Data on CeGa3Pd by Materials Project.  United States.  doi:https://doi.org/10.17188/1691018

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                    The Materials Project. 2020.  
"Materials Data on CeGa3Pd by Materials Project".  United States.  doi:https://doi.org/10.17188/1691018.  https://www.osti.gov/servlets/purl/1691018. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1691018,

  title        = {Materials Data on CeGa3Pd by Materials Project},

  author       = {The Materials Project},

  abstractNote = {CePdGa3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Ce is bonded in a 6-coordinate geometry to five equivalent Pd and twelve Ga atoms. There are a spread of Ce–Pd bond distances ranging from 3.29–3.66 Å. There are a spread of Ce–Ga bond distances ranging from 3.14–3.41 Å. Pd is bonded in a 5-coordinate geometry to five equivalent Ce and five Ga atoms. There are one shorter (2.47 Å) and four longer (2.54 Å) Pd–Ga bond lengths. There are two inequivalent Ga sites. In the first Ga site, Ga is bonded in a 1-coordinate geometry to four equivalent Ce, one Pd, and four equivalent Ga atoms. All Ga–Ga bond lengths are 2.65 Å. In the second Ga site, Ga is bonded in a distorted L-shaped geometry to four equivalent Ce, two equivalent Pd, and two equivalent Ga atoms.},

  doi          = {10.17188/1691018},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1691018

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