Materials Data on Rb2H4Pd by Materials Project

doi:10.17188/1280455

Title: Materials Data on Rb2H4Pd by Materials Project

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Abstract

Rb2PdH4 crystallizes in the tetragonal P4_2/mnm space group. The structure is three-dimensional. Rb1+ is bonded in a 8-coordinate geometry to eight H1- atoms. There are four shorter (3.01 Å) and four longer (3.03 Å) Rb–H bond lengths. Pd2+ is bonded in a square co-planar geometry to four H1- atoms. There is two shorter (1.66 Å) and two longer (1.67 Å) Pd–H bond length. There are two inequivalent H1- sites. In the first H1- site, H1- is bonded to four equivalent Rb1+ and one Pd2+ atom to form a mixture of face, edge, and corner-sharing HRb4Pd square pyramids. In the second H1- site, H1- is bonded to four equivalent Rb1+ and one Pd2+ atom to form a mixture of face, edge, and corner-sharing HRb4Pd square pyramids.

Authors:: The Materials Project

Publication Date:: Fri Jul 17 00:00:00 EDT 2020

Other Number(s):: mp-644494

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; Rb2H4Pd; H-Pd-Rb

OSTI Identifier:: 1280455

DOI:: https://doi.org/10.17188/1280455

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                    The Materials Project. Materials Data on Rb2H4Pd by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1280455.

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                    The Materials Project. Materials Data on Rb2H4Pd by Materials Project.  United States.  doi:https://doi.org/10.17188/1280455

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                    The Materials Project. 2020.  
"Materials Data on Rb2H4Pd by Materials Project".  United States.  doi:https://doi.org/10.17188/1280455.  https://www.osti.gov/servlets/purl/1280455. Pub date:Fri Jul 17 00:00:00 EDT 2020

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@article{osti_1280455,

  title        = {Materials Data on Rb2H4Pd by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Rb2PdH4 crystallizes in the tetragonal P4_2/mnm space group. The structure is three-dimensional. Rb1+ is bonded in a 8-coordinate geometry to eight H1- atoms. There are four shorter (3.01 Å) and four longer (3.03 Å) Rb–H bond lengths. Pd2+ is bonded in a square co-planar geometry to four H1- atoms. There is two shorter (1.66 Å) and two longer (1.67 Å) Pd–H bond length. There are two inequivalent H1- sites. In the first H1- site, H1- is bonded to four equivalent Rb1+ and one Pd2+ atom to form a mixture of face, edge, and corner-sharing HRb4Pd square pyramids. In the second H1- site, H1- is bonded to four equivalent Rb1+ and one Pd2+ atom to form a mixture of face, edge, and corner-sharing HRb4Pd square pyramids.},

  doi          = {10.17188/1280455},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Fri Jul 17 00:00:00 EDT 2020},

  month        = {Fri Jul 17 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1280455

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