Materials Data on Pb13(N2O13)2 by Materials Project

doi:10.17188/1312334

Title: Materials Data on Pb13(N2O13)2 by Materials Project

Full Record
Other Related Research

Abstract

Pb13O14(NO3)4 crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of four nitric acid molecules and one Pb13O14 cluster. In the Pb13O14 cluster, there are seven inequivalent Pb+2.46+ sites. In the first Pb+2.46+ site, Pb+2.46+ is bonded in a 3-coordinate geometry to three O2- atoms. There are a spread of Pb–O bond distances ranging from 2.25–2.40 Å. In the second Pb+2.46+ site, Pb+2.46+ is bonded in a 3-coordinate geometry to three O2- atoms. There are a spread of Pb–O bond distances ranging from 2.25–2.40 Å. In the third Pb+2.46+ site, Pb+2.46+ is bonded in a 3-coordinate geometry to three O2- atoms. There are a spread of Pb–O bond distances ranging from 2.25–2.40 Å. In the fourth Pb+2.46+ site, Pb+2.46+ is bonded in a body-centered cubic geometry to eight O2- atoms. There are a spread of Pb–O bond distances ranging from 2.38–2.47 Å. In the fifth Pb+2.46+ site, Pb+2.46+ is bonded in a 3-coordinate geometry to three O2- atoms. There are a spread of Pb–O bond distances ranging from 2.19–2.30 Å. In the sixth Pb+2.46+ site, Pb+2.46+ is bonded in a 3-coordinate geometry to three O2- atoms. There are a spread of Pb–O bond distances ranging frommore »« less

Authors:: The Materials Project

Publication Date:: Tue Jul 14 00:00:00 EDT 2020

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)

Contributing Org.:: MIT; UC Berkeley; Duke; U Louvain

OSTI Identifier:: 1312334

Report Number(s):: mp-868032

DOE Contract Number:: AC02-05CH11231; EDCBEE

Resource Type:: Data

Resource Relation:: Related Information: https://materialsproject.org/citing

Country of Publication:: United States

Language:: English

Subject:: 36 MATERIALS SCIENCE; crystal structure; Pb13(N2O13)2; N-O-Pb

Citation Formats


                    The Materials Project. Materials Data on Pb13(N2O13)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1312334.

Copy to clipboard


                    The Materials Project. Materials Data on Pb13(N2O13)2 by Materials Project.  United States.  https://doi.org/10.17188/1312334

Copy to clipboard


                    The Materials Project. 2020.  
        "Materials Data on Pb13(N2O13)2 by Materials Project".  United States.  https://doi.org/10.17188/1312334.  https://www.osti.gov/servlets/purl/1312334.

Copy to clipboard


                    
@article{osti_1312334,

  title        = {Materials Data on Pb13(N2O13)2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Pb13O14(NO3)4 crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of four nitric acid molecules and one Pb13O14 cluster. In the Pb13O14 cluster, there are seven inequivalent Pb+2.46+ sites. In the first Pb+2.46+ site, Pb+2.46+ is bonded in a 3-coordinate geometry to three O2- atoms. There are a spread of Pb–O bond distances ranging from 2.25–2.40 Å. In the second Pb+2.46+ site, Pb+2.46+ is bonded in a 3-coordinate geometry to three O2- atoms. There are a spread of Pb–O bond distances ranging from 2.25–2.40 Å. In the third Pb+2.46+ site, Pb+2.46+ is bonded in a 3-coordinate geometry to three O2- atoms. There are a spread of Pb–O bond distances ranging from 2.25–2.40 Å. In the fourth Pb+2.46+ site, Pb+2.46+ is bonded in a body-centered cubic geometry to eight O2- atoms. There are a spread of Pb–O bond distances ranging from 2.38–2.47 Å. In the fifth Pb+2.46+ site, Pb+2.46+ is bonded in a 3-coordinate geometry to three O2- atoms. There are a spread of Pb–O bond distances ranging from 2.19–2.30 Å. In the sixth Pb+2.46+ site, Pb+2.46+ is bonded in a 3-coordinate geometry to three O2- atoms. There are a spread of Pb–O bond distances ranging from 2.19–2.30 Å. In the seventh Pb+2.46+ site, Pb+2.46+ is bonded in a 3-coordinate geometry to three O2- atoms. There are a spread of Pb–O bond distances ranging from 2.18–2.30 Å. There are seven inequivalent O2- sites. In the first O2- site, O2- is bonded in a 2-coordinate geometry to two Pb+2.46+ atoms. In the second O2- site, O2- is bonded in a 2-coordinate geometry to two Pb+2.46+ atoms. In the third O2- site, O2- is bonded to four Pb+2.46+ atoms to form a mixture of corner and edge-sharing OPb4 tetrahedra. In the fourth O2- site, O2- is bonded to four Pb+2.46+ atoms to form a mixture of corner and edge-sharing OPb4 tetrahedra. In the fifth O2- site, O2- is bonded to four Pb+2.46+ atoms to form a mixture of corner and edge-sharing OPb4 tetrahedra. In the sixth O2- site, O2- is bonded to four Pb+2.46+ atoms to form a mixture of corner and edge-sharing OPb4 tetrahedra. In the seventh O2- site, O2- is bonded in a 2-coordinate geometry to two Pb+2.46+ atoms.},

  doi          = {10.17188/1312334},

  url          = {https://www.osti.gov/biblio/1312334},
  journal      = {},
number       = ,

  volume       = ,

  place        = {United States},

  year         = {Tue Jul 14 00:00:00 EDT 2020},

  month        = {Tue Jul 14 00:00:00 EDT 2020}

}

Copy to clipboard

Dataset:

View Dataset

https://doi.org/10.17188/1312334

Save / Share:

Export Metadata

Save to My Library

Similar records in OSTI.GOV collections:

Materials Data on Ge3Pb11O17 by Materials Project

Dataset

Pb11Ge3O17 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. there are thirty-three inequivalent Pb2+ sites. In the first Pb2+ site, Pb2+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Pb–O bond distances ranging from 2.30–3.11 Å. In the second Pb2+ site, Pb2+ is bonded to four O2- atoms to form distorted PbO4 trigonal pyramids that share a cornercorner with one GeO4 tetrahedra. There are a spread of Pb–O bond distances ranging from 2.27–2.41 Å. In the third Pb2+ site, Pb2+ is bonded in a 5-coordinate geometry to five O2- atoms.more »« less
https://doi.org/10.17188/1283516

View Dataset
Materials Data on V2Pb14Cl4O17 by Materials Project

Dataset

V2Pb14O17Cl4 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. V5+ is bonded in a tetrahedral geometry to four O2- atoms. There are a spread of V–O bond distances ranging from 1.73–1.78 Å. There are seven inequivalent Pb2+ sites. In the first Pb2+ site, Pb2+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of Pb–O bond distances ranging from 2.28–2.96 Å. In the second Pb2+ site, Pb2+ is bonded in a 4-coordinate geometry to four O2- and four Cl1- atoms. There are a spread of Pb–O bond distances ranging from 2.40–2.51 Å.more »« less
https://doi.org/10.17188/1678610

View Dataset
Materials Data on Si3Pb11O17 by Materials Project

Dataset

Pb11Si3O17 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. there are twenty-two inequivalent Pb2+ sites. In the first Pb2+ site, Pb2+ is bonded in a 3-coordinate geometry to three O2- atoms. There are a spread of Pb–O bond distances ranging from 2.32–2.38 Å. In the second Pb2+ site, Pb2+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Pb–O bond distances ranging from 2.30–3.11 Å. In the third Pb2+ site, Pb2+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Pb–O bond distances ranging frommore »« less
https://doi.org/10.17188/1706015

View Dataset
Materials Data on Pb13(Br3O5)2 by Materials Project

Dataset

Pb13(O5Br3)2 crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are twenty-six inequivalent Pb2+ sites. In the first Pb2+ site, Pb2+ is bonded in a 4-coordinate geometry to four O2- and three Br1- atoms. There are a spread of Pb–O bond distances ranging from 2.36–2.59 Å. There are a spread of Pb–Br bond distances ranging from 3.51–3.73 Å. In the second Pb2+ site, Pb2+ is bonded in a 3-coordinate geometry to three O2- and two Br1- atoms. There are a spread of Pb–O bond distances ranging from 2.24–2.38 Å. There are one shorter (3.41 Å) and onemore »« less
https://doi.org/10.17188/1278130

View Dataset
Materials Data on As2Pb14Cl4O17 by Materials Project

Dataset

Pb14As2O17Cl4 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. there are seven inequivalent Pb2+ sites. In the first Pb2+ site, Pb2+ is bonded in a 2-coordinate geometry to four O2- and three Cl1- atoms. There are a spread of Pb–O bond distances ranging from 2.32–2.87 Å. There are a spread of Pb–Cl bond distances ranging from 3.09–3.40 Å. In the second Pb2+ site, Pb2+ is bonded in a 3-coordinate geometry to three O2- and four Cl1- atoms. There are two shorter (2.30 Å) and one longer (2.52 Å) Pb–O bond lengths. There are a spread of Pb–Clmore »« less
https://doi.org/10.17188/1283721

View Dataset

Similar Records