Materials Data on LiV(CO3)2 by Materials Project

doi:10.17188/1292407

Title: Materials Data on LiV(CO3)2 by Materials Project

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Abstract

LiV(CO3)2 is Calcite-derived structured and crystallizes in the trigonal R-3 space group. The structure is three-dimensional. Li1+ is bonded to six equivalent O2- atoms to form LiO6 octahedra that share corners with six equivalent VO6 octahedra. The corner-sharing octahedral tilt angles are 59°. All Li–O bond lengths are 2.21 Å. V3+ is bonded to six equivalent O2- atoms to form VO6 octahedra that share corners with six equivalent LiO6 octahedra. The corner-sharing octahedral tilt angles are 59°. All V–O bond lengths are 2.06 Å. C4+ is bonded in a trigonal planar geometry to three equivalent O2- atoms. All C–O bond lengths are 1.30 Å. O2- is bonded in a trigonal planar geometry to one Li1+, one V3+, and one C4+ atom.

Publication Date:: Sun May 03 04:00:00 UTC 2020

Other Number(s):: mp-762019

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; C-Li-O-V; LiV(CO3)2; crystal structure

OSTI Identifier:: 1292407

DOI:: https://doi.org/10.17188/1292407

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                    Materials Data on LiV(CO3)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1292407.

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                    Materials Data on LiV(CO3)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1292407

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                    2020.  
"Materials Data on LiV(CO3)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1292407.  https://www.osti.gov/servlets/purl/1292407. Pub date:Sun May 03 04:00:00 UTC 2020

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@article{osti_1292407,

  title        = {Materials Data on LiV(CO3)2 by Materials Project},

  
  abstractNote = {LiV(CO3)2 is Calcite-derived structured and crystallizes in the trigonal R-3 space group. The structure is three-dimensional. Li1+ is bonded to six equivalent O2- atoms to form LiO6 octahedra that share corners with six equivalent VO6 octahedra. The corner-sharing octahedral tilt angles are 59°. All Li–O bond lengths are 2.21 Å. V3+ is bonded to six equivalent O2- atoms to form VO6 octahedra that share corners with six equivalent LiO6 octahedra. The corner-sharing octahedral tilt angles are 59°. All V–O bond lengths are 2.06 Å. C4+ is bonded in a trigonal planar geometry to three equivalent O2- atoms. All C–O bond lengths are 1.30 Å. O2- is bonded in a trigonal planar geometry to one Li1+, one V3+, and one C4+ atom.},

  doi          = {10.17188/1292407},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sun May 03 04:00:00 UTC 2020},

  month        = {Sun May 03 04:00:00 UTC 2020}

}

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DOI: https://doi.org/10.17188/1292407

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Materials Data on LiV(CO3)2 by Materials Project

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LiV(CO3)2 is Calcite-derived structured and crystallizes in the trigonal R32 space group. The structure is three-dimensional. Li1+ is bonded to six equivalent O2- atoms to form distorted LiO6 pentagonal pyramids that share corners with six equivalent VO6 pentagonal pyramids. All Li–O bond lengths are 2.29 Å. V3+ is bonded to six equivalent O2- atoms to form distorted VO6 pentagonal pyramids that share corners with six equivalent LiO6 pentagonal pyramids. All V–O bond lengths are 2.07 Å. C4+ is bonded in a trigonal planar geometry to three equivalent O2- atoms. All C–O bond lengths are 1.30 Å. O2- is bonded inmore »« less
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