Materials Data on Te2Ir by Materials Project

doi:10.17188/1187389

Title: Materials Data on Te2Ir by Materials Project

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Abstract

IrTe2 is Pyrite-like structured and crystallizes in the cubic Pa-3 space group. The structure is three-dimensional. Ir4+ is bonded to six equivalent Te2- atoms to form corner-sharing IrTe6 octahedra. The corner-sharing octahedral tilt angles are 62°. All Ir–Te bond lengths are 2.70 Å. Te2- is bonded in a 4-coordinate geometry to three equivalent Ir4+ and one Te2- atom. The Te–Te bond length is 3.01 Å.

Authors:: The Materials Project

Publication Date:: Thu Jul 16 00:00:00 EDT 2020

Other Number(s):: mp-10844

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; Te2Ir; Ir-Te

OSTI Identifier:: 1187389

DOI:: https://doi.org/10.17188/1187389

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                    The Materials Project. Materials Data on Te2Ir by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1187389.

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                    The Materials Project. Materials Data on Te2Ir by Materials Project.  United States.  doi:https://doi.org/10.17188/1187389

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                    The Materials Project. 2020.  
"Materials Data on Te2Ir by Materials Project".  United States.  doi:https://doi.org/10.17188/1187389.  https://www.osti.gov/servlets/purl/1187389. Pub date:Thu Jul 16 00:00:00 EDT 2020

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@article{osti_1187389,

  title        = {Materials Data on Te2Ir by Materials Project},

  author       = {The Materials Project},

  abstractNote = {IrTe2 is Pyrite-like structured and crystallizes in the cubic Pa-3 space group. The structure is three-dimensional. Ir4+ is bonded to six equivalent Te2- atoms to form corner-sharing IrTe6 octahedra. The corner-sharing octahedral tilt angles are 62°. All Ir–Te bond lengths are 2.70 Å. Te2- is bonded in a 4-coordinate geometry to three equivalent Ir4+ and one Te2- atom. The Te–Te bond length is 3.01 Å.},

  doi          = {10.17188/1187389},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Thu Jul 16 00:00:00 EDT 2020},

  month        = {Thu Jul 16 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1187389

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Materials Data on Te2Ir by Materials Project

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