Materials Data on Lu5(In2Pd)2 by Materials Project

doi:10.17188/1682688

Title: Materials Data on Lu5(In2Pd)2 by Materials Project

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Abstract

Lu5(PdIn2)2 crystallizes in the orthorhombic Pbam space group. The structure is three-dimensional. there are three inequivalent Lu sites. In the first Lu site, Lu is bonded in a distorted body-centered cubic geometry to eight In atoms. There are four shorter (3.16 Å) and four longer (3.28 Å) Lu–In bond lengths. In the second Lu site, Lu is bonded in a 10-coordinate geometry to four equivalent Pd and six In atoms. There are two shorter (2.90 Å) and two longer (2.93 Å) Lu–Pd bond lengths. There are a spread of Lu–In bond distances ranging from 3.28–3.40 Å. In the third Lu site, Lu is bonded in a 8-coordinate geometry to two equivalent Pd and six In atoms. Both Lu–Pd bond lengths are 2.81 Å. There are a spread of Lu–In bond distances ranging from 3.17–3.36 Å. Pd is bonded in a 9-coordinate geometry to six Lu and three In atoms. There are a spread of Pd–In bond distances ranging from 2.92–3.28 Å. There are two inequivalent In sites. In the first In site, In is bonded in a 9-coordinate geometry to eight Lu and one Pd atom. In the second In site, In is bonded in a 1-coordinate geometry to eightmore » Lu and two equivalent Pd atoms.« less

Authors:: The Materials Project

Publication Date:: 2019-01-11

Other Number(s):: mp-1192497

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; Lu5(In2Pd)2; In-Lu-Pd

OSTI Identifier:: 1682688

DOI:: https://doi.org/10.17188/1682688

Citation Formats


                    The Materials Project. Materials Data on Lu5(In2Pd)2 by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1682688.

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                    The Materials Project. Materials Data on Lu5(In2Pd)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1682688

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                    The Materials Project. 2019.  
"Materials Data on Lu5(In2Pd)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1682688.  https://www.osti.gov/servlets/purl/1682688. Pub date:Fri Jan 11 00:00:00 EST 2019

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@article{osti_1682688,

  title        = {Materials Data on Lu5(In2Pd)2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Lu5(PdIn2)2 crystallizes in the orthorhombic Pbam space group. The structure is three-dimensional. there are three inequivalent Lu sites. In the first Lu site, Lu is bonded in a distorted body-centered cubic geometry to eight In atoms. There are four shorter (3.16 Å) and four longer (3.28 Å) Lu–In bond lengths. In the second Lu site, Lu is bonded in a 10-coordinate geometry to four equivalent Pd and six In atoms. There are two shorter (2.90 Å) and two longer (2.93 Å) Lu–Pd bond lengths. There are a spread of Lu–In bond distances ranging from 3.28–3.40 Å. In the third Lu site, Lu is bonded in a 8-coordinate geometry to two equivalent Pd and six In atoms. Both Lu–Pd bond lengths are 2.81 Å. There are a spread of Lu–In bond distances ranging from 3.17–3.36 Å. Pd is bonded in a 9-coordinate geometry to six Lu and three In atoms. There are a spread of Pd–In bond distances ranging from 2.92–3.28 Å. There are two inequivalent In sites. In the first In site, In is bonded in a 9-coordinate geometry to eight Lu and one Pd atom. In the second In site, In is bonded in a 1-coordinate geometry to eight Lu and two equivalent Pd atoms.},

  doi          = {10.17188/1682688},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2019},

  month        = {1}

}

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DOI: https://doi.org/10.17188/1682688

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