Materials Data on Tb3Si2Ni by Materials Project

doi:10.17188/1748478

Title: Materials Data on Tb3Si2Ni by Materials Project

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Abstract

Tb3NiSi2 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are three inequivalent Tb sites. In the first Tb site, Tb is bonded in a 8-coordinate geometry to three equivalent Ni and five Si atoms. There are one shorter (2.92 Å) and two longer (3.00 Å) Tb–Ni bond lengths. There are a spread of Tb–Si bond distances ranging from 2.96–3.03 Å. In the second Tb site, Tb is bonded in a 6-coordinate geometry to one Ni and five Si atoms. The Tb–Ni bond length is 2.84 Å. There are a spread of Tb–Si bond distances ranging from 2.98–3.18 Å. In the third Tb site, Tb is bonded in a 6-coordinate geometry to two equivalent Ni and five Si atoms. Both Tb–Ni bond lengths are 2.83 Å. There are a spread of Tb–Si bond distances ranging from 2.95–3.61 Å. Ni is bonded in a 9-coordinate geometry to six Tb and three Si atoms. All Ni–Si bond lengths are 2.45 Å. There are two inequivalent Si sites. In the first Si site, Si is bonded in a 9-coordinate geometry to seven Tb and two equivalent Ni atoms. In the second Si site, Si is bonded in a 9-coordinate geometrymore » to eight Tb and one Ni atom.« less

Authors:: The Materials Project

Publication Date:: 2020-05-03

Other Number(s):: mp-1190904

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; Tb3Si2Ni; Ni-Si-Tb

OSTI Identifier:: 1748478

DOI:: https://doi.org/10.17188/1748478

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                    The Materials Project. Materials Data on Tb3Si2Ni by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1748478.

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                    The Materials Project. Materials Data on Tb3Si2Ni by Materials Project.  United States.  doi:https://doi.org/10.17188/1748478

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                    The Materials Project. 2020.  
"Materials Data on Tb3Si2Ni by Materials Project".  United States.  doi:https://doi.org/10.17188/1748478.  https://www.osti.gov/servlets/purl/1748478. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1748478,

  title        = {Materials Data on Tb3Si2Ni by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Tb3NiSi2 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are three inequivalent Tb sites. In the first Tb site, Tb is bonded in a 8-coordinate geometry to three equivalent Ni and five Si atoms. There are one shorter (2.92 Å) and two longer (3.00 Å) Tb–Ni bond lengths. There are a spread of Tb–Si bond distances ranging from 2.96–3.03 Å. In the second Tb site, Tb is bonded in a 6-coordinate geometry to one Ni and five Si atoms. The Tb–Ni bond length is 2.84 Å. There are a spread of Tb–Si bond distances ranging from 2.98–3.18 Å. In the third Tb site, Tb is bonded in a 6-coordinate geometry to two equivalent Ni and five Si atoms. Both Tb–Ni bond lengths are 2.83 Å. There are a spread of Tb–Si bond distances ranging from 2.95–3.61 Å. Ni is bonded in a 9-coordinate geometry to six Tb and three Si atoms. All Ni–Si bond lengths are 2.45 Å. There are two inequivalent Si sites. In the first Si site, Si is bonded in a 9-coordinate geometry to seven Tb and two equivalent Ni atoms. In the second Si site, Si is bonded in a 9-coordinate geometry to eight Tb and one Ni atom.},

  doi          = {10.17188/1748478},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1748478

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