Materials Data on LaPd3C by Materials Project

doi:10.17188/1349858

Title: Materials Data on LaPd3C by Materials Project

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Abstract

LaPd3C is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. La is bonded to twelve equivalent Pd atoms to form LaPd12 cuboctahedra that share corners with twelve equivalent LaPd12 cuboctahedra, faces with six equivalent LaPd12 cuboctahedra, and faces with eight equivalent CPd6 octahedra. All La–Pd bond lengths are 3.10 Å. Pd is bonded to four equivalent La and two equivalent C atoms to form a mixture of distorted edge, corner, and face-sharing PdLa4C2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°. Both Pd–C bond lengths are 2.19 Å. C is bonded to six equivalent Pd atoms to form CPd6 octahedra that share corners with six equivalent CPd6 octahedra and faces with eight equivalent LaPd12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.

Authors:: The Materials Project

Publication Date:: 2020-07-24

Other Number(s):: mp-1017581

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; LaPd3C; C-La-Pd

OSTI Identifier:: 1349858

DOI:: https://doi.org/10.17188/1349858

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                    The Materials Project. Materials Data on LaPd3C by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1349858.

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                    The Materials Project. Materials Data on LaPd3C by Materials Project.  United States.  doi:https://doi.org/10.17188/1349858

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                    The Materials Project. 2020.  
"Materials Data on LaPd3C by Materials Project".  United States.  doi:https://doi.org/10.17188/1349858.  https://www.osti.gov/servlets/purl/1349858. Pub date:Fri Jul 24 00:00:00 EDT 2020

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@article{osti_1349858,

  title        = {Materials Data on LaPd3C by Materials Project},

  author       = {The Materials Project},

  abstractNote = {LaPd3C is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. La is bonded to twelve equivalent Pd atoms to form LaPd12 cuboctahedra that share corners with twelve equivalent LaPd12 cuboctahedra, faces with six equivalent LaPd12 cuboctahedra, and faces with eight equivalent CPd6 octahedra. All La–Pd bond lengths are 3.10 Å. Pd is bonded to four equivalent La and two equivalent C atoms to form a mixture of distorted edge, corner, and face-sharing PdLa4C2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°. Both Pd–C bond lengths are 2.19 Å. C is bonded to six equivalent Pd atoms to form CPd6 octahedra that share corners with six equivalent CPd6 octahedra and faces with eight equivalent LaPd12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.},

  doi          = {10.17188/1349858},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1349858

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