Materials Data on PrInNi by Materials Project

doi:10.17188/1706035

Title: Materials Data on PrInNi by Materials Project

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Abstract

PrNiIn crystallizes in the orthorhombic Amm2 space group. The structure is three-dimensional. there are two inequivalent Pr sites. In the first Pr site, Pr is bonded in a 11-coordinate geometry to five Ni and six In atoms. There are four shorter (3.04 Å) and one longer (3.13 Å) Pr–Ni bond lengths. There are two shorter (3.27 Å) and four longer (3.38 Å) Pr–In bond lengths. In the second Pr site, Pr is bonded in a 11-coordinate geometry to five Ni and six In atoms. There are four shorter (3.04 Å) and one longer (3.14 Å) Pr–Ni bond lengths. There are two shorter (3.26 Å) and four longer (3.38 Å) Pr–In bond lengths. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 9-coordinate geometry to three Pr and six In atoms. There are four shorter (2.74 Å) and two longer (2.75 Å) Ni–In bond lengths. In the second Ni site, Ni is bonded in a 9-coordinate geometry to six Pr and three In atoms. There are two shorter (2.91 Å) and one longer (2.92 Å) Ni–In bond lengths. There are two inequivalent In sites. In the first In site, In is bonded in amore »« less

Authors:: The Materials Project

Publication Date:: 2020-05-03

Other Number(s):: mp-1079387

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; PrInNi; In-Ni-Pr

OSTI Identifier:: 1706035

DOI:: https://doi.org/10.17188/1706035

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                    The Materials Project. Materials Data on PrInNi by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1706035.

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                    The Materials Project. Materials Data on PrInNi by Materials Project.  United States.  doi:https://doi.org/10.17188/1706035

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                    The Materials Project. 2020.  
"Materials Data on PrInNi by Materials Project".  United States.  doi:https://doi.org/10.17188/1706035.  https://www.osti.gov/servlets/purl/1706035. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1706035,

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

  author       = {The Materials Project},

  abstractNote = {PrNiIn crystallizes in the orthorhombic Amm2 space group. The structure is three-dimensional. there are two inequivalent Pr sites. In the first Pr site, Pr is bonded in a 11-coordinate geometry to five Ni and six In atoms. There are four shorter (3.04 Å) and one longer (3.13 Å) Pr–Ni bond lengths. There are two shorter (3.27 Å) and four longer (3.38 Å) Pr–In bond lengths. In the second Pr site, Pr is bonded in a 11-coordinate geometry to five Ni and six In atoms. There are four shorter (3.04 Å) and one longer (3.14 Å) Pr–Ni bond lengths. There are two shorter (3.26 Å) and four longer (3.38 Å) Pr–In bond lengths. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 9-coordinate geometry to three Pr and six In atoms. There are four shorter (2.74 Å) and two longer (2.75 Å) Ni–In bond lengths. In the second Ni site, Ni is bonded in a 9-coordinate geometry to six Pr and three In atoms. There are two shorter (2.91 Å) and one longer (2.92 Å) Ni–In bond lengths. There are two inequivalent In sites. In the first In site, In is bonded in a 10-coordinate geometry to six Pr and four Ni atoms. In the second In site, In is bonded in a 10-coordinate geometry to six Pr and four Ni atoms.},

  doi          = {10.17188/1706035},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1706035

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