Materials Data on N2O3 by Materials Project

doi:10.17188/1662589

Title: Materials Data on N2O3 by Materials Project

Dataset
Other Related Research

Abstract

N2O3 is alpha Np structured and crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four ammonia molecules and four nitric acid molecules.

Authors:: The Materials Project

Publication Date:: 2020-08-03

Other Number(s):: mp-1180230

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; N2O3; N-O

OSTI Identifier:: 1662589

DOI:: https://doi.org/10.17188/1662589

Citation Formats


                    The Materials Project. Materials Data on N2O3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1662589.

Copy to clipboard


                    The Materials Project. Materials Data on N2O3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1662589

Copy to clipboard


                    The Materials Project. 2020.  
"Materials Data on N2O3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1662589.  https://www.osti.gov/servlets/purl/1662589. Pub date:Mon Aug 03 00:00:00 EDT 2020

Copy to clipboard


                    
@article{osti_1662589,

  title        = {Materials Data on N2O3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {N2O3 is alpha Np structured and crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four ammonia molecules and four nitric acid molecules.},

  doi          = {10.17188/1662589},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {8}

}

Copy to clipboard

Dataset:

View Dataset

DOI: https://doi.org/10.17188/1662589

Save / Share:

Export Metadata

Save to My Library

Similar records in DOE Data Explorer and OSTI.GOV collections:

Materials Data on NiH10C2(N2O3)2 by Materials Project

Dataset The Materials Project

NiC2H10(N2O3)2 crystallizes in the monoclinic C2/c space group. The structure is two-dimensional and consists of two NiC2H10(N2O3)2 sheets oriented in the (0, 0, 1) direction. Ni2+ is bonded in an octahedral geometry to two equivalent N2- and four O2- atoms. Both Ni–N bond lengths are 2.08 Å. There are two shorter (2.04 Å) and two longer (2.17 Å) Ni–O bond lengths. C4+ is bonded in a trigonal planar geometry to one N2- and two O2- atoms. The C–N bond length is 1.37 Å. Both C–O bond lengths are 1.28 Å. There are two inequivalent N2- sites. In the first N2-more »« less
Materials Data on H14RuS2(N2O3)2 by Materials Project

Dataset The Materials Project

RuH14S2(N2O3)2 crystallizes in the monoclinic P2_1/c space group. The structure is one-dimensional and consists of two RuH14S2(N2O3)2 ribbons oriented in the (0, 1, 0) direction. Ru6+ is bonded in an octahedral geometry to four N1- and two equivalent S2- atoms. There are two shorter (2.14 Å) and two longer (2.18 Å) Ru–N bond lengths. Both Ru–S bond lengths are 2.28 Å. There are two inequivalent N1- sites. In the first N1- site, N1- is bonded in a distorted trigonal non-coplanar geometry to one Ru6+ and three H1+ atoms. There is two shorter (1.02 Å) and one longer (1.03 Å) N–Hmore »« less
Materials Data on Na2CuH20C12(N2O3)6 by Materials Project

Dataset The Materials Project

Na2CuC12H20(N2O3)6 crystallizes in the triclinic P-1 space group. The structure is two-dimensional and consists of one Na2CuC12H20(N2O3)6 sheet oriented in the (0, 1, 1) direction. Na1+ is bonded to six O2- atoms to form edge-sharing NaO6 octahedra. There are a spread of Na–O bond distances ranging from 2.34–2.66 Å. Cu2+ is bonded in a square co-planar geometry to two equivalent N3- and two equivalent O2- atoms. Both Cu–N bond lengths are 1.95 Å. Both Cu–O bond lengths are 1.98 Å. There are six inequivalent C4+ sites. In the first C4+ site, C4+ is bonded in a trigonal planar geometry tomore »« less
Materials Data on CoNiH12C4(N2O3)2 by Materials Project

Dataset The Materials Project

NiCoC4H4(N2O)2(H2O)4 crystallizes in the orthorhombic Pnma space group. The structure is zero-dimensional and consists of four nickel molecules, sixteen water molecules, and four CoC4H4(N2O)2 clusters. In each CoC4H4(N2O)2 cluster, Co2+ is bonded in an octahedral geometry to four N3- and two equivalent O2- atoms. There are two shorter (2.09 Å) and two longer (2.11 Å) Co–N bond lengths. Both Co–O bond lengths are 2.15 Å. There are two inequivalent C2+ sites. In the first C2+ site, C2+ is bonded in a single-bond geometry to one N3- atom. The C–N bond length is 1.17 Å. In the second C2+ site, C2+more »« less
Materials Data on CoH10C4(N2O3)2 (SG:15) by Materials Project

Dataset The Materials Project

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

Similar Records