Materials Data on K2PtN4(ClO4)2 by Materials Project

doi:10.17188/1281655

Title: Materials Data on K2PtN4(ClO4)2 by Materials Project

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Abstract

K2PtN4(O4Cl)2 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. K1+ is bonded in a 10-coordinate geometry to seven O2- and three equivalent Cl1- atoms. There are a spread of K–O bond distances ranging from 2.94–3.23 Å. There are a spread of K–Cl bond distances ranging from 3.44–3.66 Å. Pt4+ is bonded in a linear geometry to two equivalent Cl1- atoms. Both Pt–Cl bond lengths are 2.36 Å. There are two inequivalent N3+ sites. In the first N3+ site, N3+ is bonded in a bent 120 degrees geometry to two O2- atoms. Both N–O bond lengths are 1.24 Å. In the second N3+ site, N3+ is bonded in a bent 120 degrees geometry to two O2- atoms. Both N–O bond lengths are 1.24 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent K1+ and one N3+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent K1+ and one N3+ atom. In the third O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent K1+ and one N3+ atom. In the fourth O2- site,more »« less

Publication Date:: Wed Jul 22 00:00:00 EDT 2020

Other Number(s):: mp-669540

DOE Contract Number:: AC02-05CH11231

Research Org.:: LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

Sponsoring Org.:: USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)

Collaborations:: The Materials Project; MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE; Cl-K-N-O-Pt; K2PtN4(ClO4)2; crystal structure

OSTI Identifier:: 1281655

DOI:: https://doi.org/10.17188/1281655

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                    Materials Data on K2PtN4(ClO4)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1281655.

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                    Materials Data on K2PtN4(ClO4)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1281655

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                    2020.  
"Materials Data on K2PtN4(ClO4)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1281655.  https://www.osti.gov/servlets/purl/1281655. Pub date:Wed Jul 22 00:00:00 EDT 2020

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@article{osti_1281655,

  title        = {Materials Data on K2PtN4(ClO4)2 by Materials Project},

  
  abstractNote = {K2PtN4(O4Cl)2 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. K1+ is bonded in a 10-coordinate geometry to seven O2- and three equivalent Cl1- atoms. There are a spread of K–O bond distances ranging from 2.94–3.23 Å. There are a spread of K–Cl bond distances ranging from 3.44–3.66 Å. Pt4+ is bonded in a linear geometry to two equivalent Cl1- atoms. Both Pt–Cl bond lengths are 2.36 Å. There are two inequivalent N3+ sites. In the first N3+ site, N3+ is bonded in a bent 120 degrees geometry to two O2- atoms. Both N–O bond lengths are 1.24 Å. In the second N3+ site, N3+ is bonded in a bent 120 degrees geometry to two O2- atoms. Both N–O bond lengths are 1.24 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent K1+ and one N3+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent K1+ and one N3+ atom. In the third O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent K1+ and one N3+ atom. In the fourth O2- site, O2- is bonded in a distorted single-bond geometry to one K1+ and one N3+ atom. Cl1- is bonded in a distorted single-bond geometry to three equivalent K1+ and one Pt4+ atom.},

  doi          = {10.17188/1281655},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Wed Jul 22 00:00:00 EDT 2020},

  month        = {Wed Jul 22 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1281655

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