Materials Data on Rb2Pd3S2 by Materials Project

doi:10.17188/1695807

Title: Materials Data on Rb2Pd3S2 by Materials Project

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Abstract

Rb2Pd3S2 crystallizes in the orthorhombic Fddd space group. The structure is two-dimensional and consists of four Rb2Pd3S2 sheets oriented in the (0, 0, 1) direction. Rb is bonded in a 4-coordinate geometry to two equivalent Pd and two equivalent S atoms. There are one shorter (3.20 Å) and one longer (3.30 Å) Rb–Pd bond lengths. There are one shorter (3.40 Å) and one longer (3.41 Å) Rb–S bond lengths. There are two inequivalent Pd sites. In the first Pd site, Pd is bonded in a 1-coordinate geometry to two equivalent Rb and one S atom. The Pd–S bond length is 2.29 Å. In the second Pd site, Pd is bonded in a distorted linear geometry to two equivalent S atoms. Both Pd–S bond lengths are 2.38 Å. S is bonded in a 5-coordinate geometry to two equivalent Rb, two Pd, and one S atom. The S–S bond length is 2.23 Å.

Authors:: The Materials Project

Publication Date:: Sat Jan 12 00:00:00 EST 2019

Other Number(s):: mp-1211069

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; Rb2Pd3S2; Pd-Rb-S

OSTI Identifier:: 1695807

DOI:: https://doi.org/10.17188/1695807

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                    The Materials Project. Materials Data on Rb2Pd3S2 by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1695807.

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                    The Materials Project. Materials Data on Rb2Pd3S2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1695807

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                    The Materials Project. 2019.  
"Materials Data on Rb2Pd3S2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1695807.  https://www.osti.gov/servlets/purl/1695807. Pub date:Sat Jan 12 00:00:00 EST 2019

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@article{osti_1695807,

  title        = {Materials Data on Rb2Pd3S2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Rb2Pd3S2 crystallizes in the orthorhombic Fddd space group. The structure is two-dimensional and consists of four Rb2Pd3S2 sheets oriented in the (0, 0, 1) direction. Rb is bonded in a 4-coordinate geometry to two equivalent Pd and two equivalent S atoms. There are one shorter (3.20 Å) and one longer (3.30 Å) Rb–Pd bond lengths. There are one shorter (3.40 Å) and one longer (3.41 Å) Rb–S bond lengths. There are two inequivalent Pd sites. In the first Pd site, Pd is bonded in a 1-coordinate geometry to two equivalent Rb and one S atom. The Pd–S bond length is 2.29 Å. In the second Pd site, Pd is bonded in a distorted linear geometry to two equivalent S atoms. Both Pd–S bond lengths are 2.38 Å. S is bonded in a 5-coordinate geometry to two equivalent Rb, two Pd, and one S atom. The S–S bond length is 2.23 Å.},

  doi          = {10.17188/1695807},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat Jan 12 00:00:00 EST 2019},

  month        = {Sat Jan 12 00:00:00 EST 2019}

}

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DOI: https://doi.org/10.17188/1695807

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