Materials Data on PdS(NO)3 by Materials Project

doi:10.17188/1692733

Title: Materials Data on PdS(NO)3 by Materials Project

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Abstract

PdN3SO3 is Ammonia-derived structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four sulfur trioxide molecules and four PdN3 clusters. In each PdN3 cluster, Pd2+ is bonded in a distorted trigonal non-coplanar geometry to three N2+ atoms. There are a spread of Pd–N bond distances ranging from 1.76–1.91 Å. There are three inequivalent N2+ sites. In the first N2+ site, N2+ is bonded in a single-bond geometry to one Pd2+ atom. In the second N2+ site, N2+ is bonded in a single-bond geometry to one Pd2+ atom. In the third N2+ site, N2+ is bonded in a single-bond geometry to one Pd2+ atom.

Authors:: The Materials Project

Publication Date:: 2020-04-30

Other Number(s):: mp-1179965

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; PdS(NO)3; N-O-Pd-S

OSTI Identifier:: 1692733

DOI:: https://doi.org/10.17188/1692733

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                    The Materials Project. Materials Data on PdS(NO)3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1692733.

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                    The Materials Project. Materials Data on PdS(NO)3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1692733

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                    The Materials Project. 2020.  
"Materials Data on PdS(NO)3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1692733.  https://www.osti.gov/servlets/purl/1692733. Pub date:Thu Apr 30 00:00:00 EDT 2020

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@article{osti_1692733,

  title        = {Materials Data on PdS(NO)3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {PdN3SO3 is Ammonia-derived structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four sulfur trioxide molecules and four PdN3 clusters. In each PdN3 cluster, Pd2+ is bonded in a distorted trigonal non-coplanar geometry to three N2+ atoms. There are a spread of Pd–N bond distances ranging from 1.76–1.91 Å. There are three inequivalent N2+ sites. In the first N2+ site, N2+ is bonded in a single-bond geometry to one Pd2+ atom. In the second N2+ site, N2+ is bonded in a single-bond geometry to one Pd2+ atom. In the third N2+ site, N2+ is bonded in a single-bond geometry to one Pd2+ atom.},

  doi          = {10.17188/1692733},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {4}

}

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DOI: https://doi.org/10.17188/1692733

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