Materials Data on Ga2SeS by Materials Project

doi:10.17188/1734018

Title: Materials Data on Ga2SeS by Materials Project

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Abstract

GaSeGaS is Hittorf-derived structured and crystallizes in the trigonal P-3m1 space group. The structure is two-dimensional and consists of two GaS sheets oriented in the (0, 0, 1) direction and two GaSe sheets oriented in the (0, 0, 1) direction. In each GaS sheet, Ga2+ is bonded in a trigonal non-coplanar geometry to three equivalent S2- atoms. All Ga–S bond lengths are 2.39 Å. S2- is bonded in a trigonal non-coplanar geometry to three equivalent Ga2+ atoms. In each GaSe sheet, Ga2+ is bonded in a distorted trigonal non-coplanar geometry to three equivalent Se2- atoms. All Ga–Se bond lengths are 2.47 Å. Se2- is bonded in a 3-coordinate geometry to three equivalent Ga2+ atoms.

Authors:: The Materials Project

Publication Date:: 2019-01-13

Other Number(s):: mp-1224822

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; Ga2SeS; Ga-S-Se

OSTI Identifier:: 1734018

DOI:: https://doi.org/10.17188/1734018

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                    The Materials Project. Materials Data on Ga2SeS by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1734018.

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                    The Materials Project. Materials Data on Ga2SeS by Materials Project.  United States.  doi:https://doi.org/10.17188/1734018

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                    The Materials Project. 2019.  
"Materials Data on Ga2SeS by Materials Project".  United States.  doi:https://doi.org/10.17188/1734018.  https://www.osti.gov/servlets/purl/1734018. Pub date:Sun Jan 13 00:00:00 EST 2019

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@article{osti_1734018,

  title        = {Materials Data on Ga2SeS by Materials Project},

  author       = {The Materials Project},

  abstractNote = {GaSeGaS is Hittorf-derived structured and crystallizes in the trigonal P-3m1 space group. The structure is two-dimensional and consists of two GaS sheets oriented in the (0, 0, 1) direction and two GaSe sheets oriented in the (0, 0, 1) direction. In each GaS sheet, Ga2+ is bonded in a trigonal non-coplanar geometry to three equivalent S2- atoms. All Ga–S bond lengths are 2.39 Å. S2- is bonded in a trigonal non-coplanar geometry to three equivalent Ga2+ atoms. In each GaSe sheet, Ga2+ is bonded in a distorted trigonal non-coplanar geometry to three equivalent Se2- atoms. All Ga–Se bond lengths are 2.47 Å. Se2- is bonded in a 3-coordinate geometry to three equivalent Ga2+ atoms.},

  doi          = {10.17188/1734018},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2019},

  month        = {1}

}

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DOI: https://doi.org/10.17188/1734018

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