Materials Data on CeIn2Pd3 by Materials Project

doi:10.17188/1664233

Title: Materials Data on CeIn2Pd3 by Materials Project

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Abstract

CePd3In2 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Ce is bonded in a 1-coordinate geometry to nine Pd and one In atom. There are a spread of Ce–Pd bond distances ranging from 2.94–3.47 Å. The Ce–In bond length is 3.28 Å. There are three inequivalent Pd sites. In the first Pd site, Pd is bonded in a 10-coordinate geometry to three equivalent Ce, two equivalent Pd, and five In atoms. Both Pd–Pd bond lengths are 2.88 Å. There are a spread of Pd–In bond distances ranging from 2.75–3.01 Å. In the second Pd site, Pd is bonded in a 11-coordinate geometry to three equivalent Ce, four Pd, and four In atoms. There are one shorter (2.84 Å) and one longer (3.07 Å) Pd–Pd bond lengths. There are a spread of Pd–In bond distances ranging from 2.76–3.06 Å. In the third Pd site, Pd is bonded in a 8-coordinate geometry to three equivalent Ce, two equivalent Pd, and four In atoms. There are a spread of Pd–In bond distances ranging from 2.75–2.82 Å. There are two inequivalent In sites. In the first In site, In is bonded in a 5-coordinate geometry to six Pd atoms. In themore »« less

Authors:: The Materials Project

Publication Date:: Thu Jul 23 00:00:00 EDT 2020

Other Number(s):: mp-1191263

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; CeIn2Pd3; Ce-In-Pd

OSTI Identifier:: 1664233

DOI:: https://doi.org/10.17188/1664233

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                    The Materials Project. Materials Data on CeIn2Pd3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1664233.

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                    The Materials Project. Materials Data on CeIn2Pd3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1664233

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                    The Materials Project. 2020.  
"Materials Data on CeIn2Pd3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1664233.  https://www.osti.gov/servlets/purl/1664233. Pub date:Thu Jul 23 00:00:00 EDT 2020

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@article{osti_1664233,

  title        = {Materials Data on CeIn2Pd3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {CePd3In2 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Ce is bonded in a 1-coordinate geometry to nine Pd and one In atom. There are a spread of Ce–Pd bond distances ranging from 2.94–3.47 Å. The Ce–In bond length is 3.28 Å. There are three inequivalent Pd sites. In the first Pd site, Pd is bonded in a 10-coordinate geometry to three equivalent Ce, two equivalent Pd, and five In atoms. Both Pd–Pd bond lengths are 2.88 Å. There are a spread of Pd–In bond distances ranging from 2.75–3.01 Å. In the second Pd site, Pd is bonded in a 11-coordinate geometry to three equivalent Ce, four Pd, and four In atoms. There are one shorter (2.84 Å) and one longer (3.07 Å) Pd–Pd bond lengths. There are a spread of Pd–In bond distances ranging from 2.76–3.06 Å. In the third Pd site, Pd is bonded in a 8-coordinate geometry to three equivalent Ce, two equivalent Pd, and four In atoms. There are a spread of Pd–In bond distances ranging from 2.75–2.82 Å. There are two inequivalent In sites. In the first In site, In is bonded in a 5-coordinate geometry to six Pd atoms. In the second In site, In is bonded in a 8-coordinate geometry to one Ce and seven Pd atoms.},

  doi          = {10.17188/1664233},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Thu Jul 23 00:00:00 EDT 2020},

  month        = {Thu Jul 23 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1664233

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