Materials Data on Np2Se5 by Materials Project

doi:10.17188/1734240

Title: Materials Data on Np2Se5 by Materials Project

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Abstract

Np2Se5 crystallizes in the orthorhombic Pbcn space group. The structure is three-dimensional. Np5+ is bonded in a 10-coordinate geometry to ten Se2- atoms. There are a spread of Np–Se bond distances ranging from 2.92–3.11 Å. There are three inequivalent Se2- sites. In the first Se2- site, Se2- is bonded in a 4-coordinate geometry to four equivalent Np5+ and one Se2- atom. The Se–Se bond length is 2.80 Å. In the second Se2- site, Se2- is bonded in a 6-coordinate geometry to four equivalent Np5+ and two Se2- atoms. The Se–Se bond length is 2.63 Å. In the third Se2- site, Se2- is bonded to four equivalent Np5+ atoms to form distorted corner-sharing SeNp4 trigonal pyramids.

Authors:: The Materials Project

Publication Date:: 2019-01-11

Other Number(s):: mp-1193639

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; Np2Se5; Np-Se

OSTI Identifier:: 1734240

DOI:: https://doi.org/10.17188/1734240

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                    The Materials Project. Materials Data on Np2Se5 by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1734240.

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                    The Materials Project. Materials Data on Np2Se5 by Materials Project.  United States.  doi:https://doi.org/10.17188/1734240

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                    The Materials Project. 2019.  
"Materials Data on Np2Se5 by Materials Project".  United States.  doi:https://doi.org/10.17188/1734240.  https://www.osti.gov/servlets/purl/1734240. Pub date:Fri Jan 11 00:00:00 EST 2019

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@article{osti_1734240,

  title        = {Materials Data on Np2Se5 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Np2Se5 crystallizes in the orthorhombic Pbcn space group. The structure is three-dimensional. Np5+ is bonded in a 10-coordinate geometry to ten Se2- atoms. There are a spread of Np–Se bond distances ranging from 2.92–3.11 Å. There are three inequivalent Se2- sites. In the first Se2- site, Se2- is bonded in a 4-coordinate geometry to four equivalent Np5+ and one Se2- atom. The Se–Se bond length is 2.80 Å. In the second Se2- site, Se2- is bonded in a 6-coordinate geometry to four equivalent Np5+ and two Se2- atoms. The Se–Se bond length is 2.63 Å. In the third Se2- site, Se2- is bonded to four equivalent Np5+ atoms to form distorted corner-sharing SeNp4 trigonal pyramids.},

  doi          = {10.17188/1734240},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2019},

  month        = {1}

}

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DOI: https://doi.org/10.17188/1734240

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