Materials Data on LaNiSnH2 by Materials Project

doi:10.17188/1200236

Title: Materials Data on LaNiSnH2 by Materials Project

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Abstract

LaNiSnH2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. La is bonded in a distorted hexagonal planar geometry to six equivalent Sn and six equivalent H atoms. All La–Sn bond lengths are 3.36 Å. There are four shorter (2.63 Å) and two longer (2.64 Å) La–H bond lengths. Ni is bonded in a linear geometry to three equivalent Sn and two equivalent H atoms. All Ni–Sn bond lengths are 2.57 Å. Both Ni–H bond lengths are 1.60 Å. Sn is bonded in a distorted trigonal planar geometry to six equivalent La and three equivalent Ni atoms. H is bonded to three equivalent La and one Ni atom to form a mixture of distorted edge and corner-sharing HLa3Ni tetrahedra.

Authors:: The Materials Project

Publication Date:: 2020-07-18

Other Number(s):: mp-24805

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; LaNiSnH2; H-La-Ni-Sn

OSTI Identifier:: 1200236

DOI:: https://doi.org/10.17188/1200236

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                    The Materials Project. Materials Data on LaNiSnH2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1200236.

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                    The Materials Project. Materials Data on LaNiSnH2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1200236

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                    The Materials Project. 2020.  
"Materials Data on LaNiSnH2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1200236.  https://www.osti.gov/servlets/purl/1200236. Pub date:Sat Jul 18 00:00:00 EDT 2020

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@article{osti_1200236,

  title        = {Materials Data on LaNiSnH2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {LaNiSnH2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. La is bonded in a distorted hexagonal planar geometry to six equivalent Sn and six equivalent H atoms. All La–Sn bond lengths are 3.36 Å. There are four shorter (2.63 Å) and two longer (2.64 Å) La–H bond lengths. Ni is bonded in a linear geometry to three equivalent Sn and two equivalent H atoms. All Ni–Sn bond lengths are 2.57 Å. Both Ni–H bond lengths are 1.60 Å. Sn is bonded in a distorted trigonal planar geometry to six equivalent La and three equivalent Ni atoms. H is bonded to three equivalent La and one Ni atom to form a mixture of distorted edge and corner-sharing HLa3Ni tetrahedra.},

  doi          = {10.17188/1200236},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1200236

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