Materials Data on C by Materials Project

doi:10.17188/1277856

Title: Materials Data on C by Materials Project

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Abstract

C is diamond-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are four inequivalent C sites. In the first C site, C is bonded to four C atoms to form corner-sharing CC4 tetrahedra. All C–C bond lengths are 1.55 Å. In the second C site, C is bonded to four C atoms to form corner-sharing CC4 tetrahedra. There is three shorter (1.55 Å) and one longer (1.57 Å) C–C bond length. In the third C site, C is bonded to four C atoms to form corner-sharing CC4 tetrahedra. The C–C bond length is 1.55 Å. In the fourth C site, C is bonded to four C atoms to form corner-sharing CC4 tetrahedra.

Authors:: The Materials Project

Publication Date:: Wed Jul 22 00:00:00 EDT 2020

Other Number(s):: mp-616440

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; C; C

OSTI Identifier:: 1277856

DOI:: https://doi.org/10.17188/1277856

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                    The Materials Project. Materials Data on C by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1277856.

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                    The Materials Project. Materials Data on C by Materials Project.  United States.  doi:https://doi.org/10.17188/1277856

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                    The Materials Project. 2020.  
"Materials Data on C by Materials Project".  United States.  doi:https://doi.org/10.17188/1277856.  https://www.osti.gov/servlets/purl/1277856. Pub date:Wed Jul 22 00:00:00 EDT 2020

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@article{osti_1277856,

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

  author       = {The Materials Project},

  abstractNote = {C is diamond-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are four inequivalent C sites. In the first C site, C is bonded to four C atoms to form corner-sharing CC4 tetrahedra. All C–C bond lengths are 1.55 Å. In the second C site, C is bonded to four C atoms to form corner-sharing CC4 tetrahedra. There is three shorter (1.55 Å) and one longer (1.57 Å) C–C bond length. In the third C site, C is bonded to four C atoms to form corner-sharing CC4 tetrahedra. The C–C bond length is 1.55 Å. In the fourth C site, C is bonded to four C atoms to form corner-sharing CC4 tetrahedra.},

  doi          = {10.17188/1277856},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Wed Jul 22 00:00:00 EDT 2020},

  month        = {Wed Jul 22 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1277856

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