Materials Data on H9Au(ClO)4 by Materials Project

doi:10.17188/1687941

Title: Materials Data on H9Au(ClO)4 by Materials Project

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Abstract

AuCl4(H2O)2H5O2 crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one molecular hydrogen;dihydrate molecule, two water molecules, and one AuCl4 cluster. In the AuCl4 cluster, Au3+ is bonded in a rectangular see-saw-like geometry to four Cl1- atoms. There are one shorter (2.31 Å) and three longer (2.32 Å) Au–Cl bond lengths. There are four inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a single-bond geometry to one Au3+ atom. In the second Cl1- site, Cl1- is bonded in a single-bond geometry to one Au3+ atom. In the third Cl1- site, Cl1- is bonded in a single-bond geometry to one Au3+ atom. In the fourth Cl1- site, Cl1- is bonded in a single-bond geometry to one Au3+ atom.

Authors:: The Materials Project

Publication Date:: 2020-05-02

Other Number(s):: mp-1224602

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; H9Au(ClO)4; Au-Cl-H-O

OSTI Identifier:: 1687941

DOI:: https://doi.org/10.17188/1687941

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                    The Materials Project. Materials Data on H9Au(ClO)4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1687941.

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                    The Materials Project. Materials Data on H9Au(ClO)4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1687941

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                    The Materials Project. 2020.  
"Materials Data on H9Au(ClO)4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1687941.  https://www.osti.gov/servlets/purl/1687941. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1687941,

  title        = {Materials Data on H9Au(ClO)4 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {AuCl4(H2O)2H5O2 crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one molecular hydrogen;dihydrate molecule, two water molecules, and one AuCl4 cluster. In the AuCl4 cluster, Au3+ is bonded in a rectangular see-saw-like geometry to four Cl1- atoms. There are one shorter (2.31 Å) and three longer (2.32 Å) Au–Cl bond lengths. There are four inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a single-bond geometry to one Au3+ atom. In the second Cl1- site, Cl1- is bonded in a single-bond geometry to one Au3+ atom. In the third Cl1- site, Cl1- is bonded in a single-bond geometry to one Au3+ atom. In the fourth Cl1- site, Cl1- is bonded in a single-bond geometry to one Au3+ atom.},

  doi          = {10.17188/1687941},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1687941

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