Materials Data on Er2PtAu by Materials Project

doi:10.17188/1684594

Title: Materials Data on Er2PtAu by Materials Project

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Abstract

Er2PtAu crystallizes in the orthorhombic Pmc2_1 space group. The structure is three-dimensional. there are two inequivalent Er sites. In the first Er site, Er is bonded in a 7-coordinate geometry to four equivalent Pt and three equivalent Au atoms. There are two shorter (3.01 Å) and two longer (3.02 Å) Er–Pt bond lengths. There are a spread of Er–Au bond distances ranging from 2.92–3.02 Å. In the second Er site, Er is bonded in a 7-coordinate geometry to three equivalent Pt and four equivalent Au atoms. There are a spread of Er–Pt bond distances ranging from 2.84–3.06 Å. There are two shorter (3.02 Å) and two longer (3.04 Å) Er–Au bond lengths. Pt is bonded in a 9-coordinate geometry to seven Er and two equivalent Au atoms. Both Pt–Au bond lengths are 2.93 Å. Au is bonded in a 9-coordinate geometry to seven Er and two equivalent Pt atoms.

Authors:: The Materials Project

Publication Date:: 2019-01-13

Other Number(s):: mp-1225611

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; Er2PtAu; Au-Er-Pt

OSTI Identifier:: 1684594

DOI:: https://doi.org/10.17188/1684594

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                    The Materials Project. Materials Data on Er2PtAu by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1684594.

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                    The Materials Project. Materials Data on Er2PtAu by Materials Project.  United States.  doi:https://doi.org/10.17188/1684594

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                    The Materials Project. 2019.  
"Materials Data on Er2PtAu by Materials Project".  United States.  doi:https://doi.org/10.17188/1684594.  https://www.osti.gov/servlets/purl/1684594. Pub date:Sun Jan 13 00:00:00 EST 2019

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@article{osti_1684594,

  title        = {Materials Data on Er2PtAu by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Er2PtAu crystallizes in the orthorhombic Pmc2_1 space group. The structure is three-dimensional. there are two inequivalent Er sites. In the first Er site, Er is bonded in a 7-coordinate geometry to four equivalent Pt and three equivalent Au atoms. There are two shorter (3.01 Å) and two longer (3.02 Å) Er–Pt bond lengths. There are a spread of Er–Au bond distances ranging from 2.92–3.02 Å. In the second Er site, Er is bonded in a 7-coordinate geometry to three equivalent Pt and four equivalent Au atoms. There are a spread of Er–Pt bond distances ranging from 2.84–3.06 Å. There are two shorter (3.02 Å) and two longer (3.04 Å) Er–Au bond lengths. Pt is bonded in a 9-coordinate geometry to seven Er and two equivalent Au atoms. Both Pt–Au bond lengths are 2.93 Å. Au is bonded in a 9-coordinate geometry to seven Er and two equivalent Pt atoms.},

  doi          = {10.17188/1684594},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2019},

  month        = {1}

}

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DOI: https://doi.org/10.17188/1684594

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