Materials Data on SiO2 by Materials Project

doi:10.17188/1183680

Title: Materials Data on SiO2 by Materials Project

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Abstract

SiO2 is Rutile structured and crystallizes in the tetragonal P4_2/mnm space group. The structure is three-dimensional. Si4+ is bonded to six equivalent O2- atoms to form a mixture of corner and edge-sharing SiO6 octahedra. The corner-sharing octahedral tilt angles are 49°. There is four shorter (1.78 Å) and two longer (1.84 Å) Si–O bond length. O2- is bonded in a distorted trigonal planar geometry to three equivalent Si4+ atoms.

Publication Date:: 2020-07-14

Other Number(s):: mp-6947

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; crystal structure; O-Si; SiO2

OSTI Identifier:: 1183680

DOI:: https://doi.org/10.17188/1183680

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                    Materials Data on SiO2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1183680.

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                    Materials Data on SiO2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1183680

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                    2020.  
"Materials Data on SiO2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1183680.  https://www.osti.gov/servlets/purl/1183680. Pub date:Tue Jul 14 20:00:00 EDT 2020

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@article{osti_1183680,

  title        = {Materials Data on SiO2 by Materials Project},

  
  abstractNote = {SiO2 is Rutile structured and crystallizes in the tetragonal P4_2/mnm space group. The structure is three-dimensional. Si4+ is bonded to six equivalent O2- atoms to form a mixture of corner and edge-sharing SiO6 octahedra. The corner-sharing octahedral tilt angles are 49°. There is four shorter (1.78 Å) and two longer (1.84 Å) Si–O bond length. O2- is bonded in a distorted trigonal planar geometry to three equivalent Si4+ atoms.},

  doi          = {10.17188/1183680},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1183680

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