Materials Data on HgTe by Materials Project

doi:10.17188/1191011

Title: Materials Data on HgTe by Materials Project

Dataset
Other Related Research

Abstract

HgTe crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Hg2+ is bonded to five equivalent Te2- atoms to form a mixture of distorted corner and edge-sharing HgTe5 trigonal bipyramids. There are a spread of Hg–Te bond distances ranging from 3.02–3.06 Å. Te2- is bonded in a 5-coordinate geometry to five equivalent Hg2+ atoms.

Authors:: The Materials Project

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

Other Number(s):: mp-1507

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; HgTe; Hg-Te

OSTI Identifier:: 1191011

DOI:: https://doi.org/10.17188/1191011

Citation Formats


                    The Materials Project. Materials Data on HgTe by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1191011.

Copy to clipboard


                    The Materials Project. Materials Data on HgTe by Materials Project.  United States.  doi:https://doi.org/10.17188/1191011

Copy to clipboard


                    The Materials Project. 2020.  
"Materials Data on HgTe by Materials Project".  United States.  doi:https://doi.org/10.17188/1191011.  https://www.osti.gov/servlets/purl/1191011. Pub date:Thu Jul 16 00:00:00 EDT 2020

Copy to clipboard


                    
@article{osti_1191011,

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

  author       = {The Materials Project},

  abstractNote = {HgTe crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Hg2+ is bonded to five equivalent Te2- atoms to form a mixture of distorted corner and edge-sharing HgTe5 trigonal bipyramids. There are a spread of Hg–Te bond distances ranging from 3.02–3.06 Å. Te2- is bonded in a 5-coordinate geometry to five equivalent Hg2+ atoms.},

  doi          = {10.17188/1191011},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

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

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

}

Copy to clipboard

Dataset:

View Dataset

DOI: https://doi.org/10.17188/1191011

Save / Share:

Export Metadata

Save to My Library

Similar records in DOE Data Explorer and OSTI.GOV collections:

Materials Data on HgTe by Materials Project

Dataset The Materials Project

HgTe is Cinnabar structured and crystallizes in the trigonal P3_121 space group. The structure is three-dimensional. Hg2+ is bonded to six equivalent Te2- atoms to form a mixture of distorted edge and corner-sharing HgTe6 octahedra. The corner-sharing octahedra tilt angles range from 17–24°. There are a spread of Hg–Te bond distances ranging from 2.76–3.76 Å. Te2- is bonded in a 6-coordinate geometry to six equivalent Hg2+ atoms.
Materials Data on HgTe by Materials Project

Dataset The Materials Project

HgTe is Zincblende, Sphalerite structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Hg2+ is bonded to four equivalent Te2- atoms to form corner-sharing HgTe4 tetrahedra. All Hg–Te bond lengths are 2.88 Å. Te2- is bonded to four equivalent Hg2+ atoms to form corner-sharing TeHg4 tetrahedra.
Materials Data on HgTe by Materials Project

Dataset The Materials Project

HgTe is Tetraauricupride structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Hg2+ is bonded in a body-centered cubic geometry to eight equivalent Te2- atoms. All Hg–Te bond lengths are 3.30 Å. Te2- is bonded in a body-centered cubic geometry to eight equivalent Hg2+ atoms.
Materials Data on HgTe by Materials Project

Dataset The Materials Project

HgTe is Halite, Rock Salt structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Hg2+ is bonded to six equivalent Te2- atoms to form a mixture of edge and corner-sharing HgTe6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Hg–Te bond lengths are 3.08 Å. Te2- is bonded to six equivalent Hg2+ atoms to form a mixture of edge and corner-sharing TeHg6 octahedra. The corner-sharing octahedral tilt angles are 0°.
Materials Data on HgTe(HO)7 by Materials Project

Dataset The Materials Project

HgH5TeO6H2O crystallizes in the triclinic P-1 space group. The structure is one-dimensional and consists of two water molecules and one HgH5TeO6 ribbon oriented in the (0, 1, 1) direction. In the HgH5TeO6 ribbon, Hg1+ is bonded in a distorted single-bond geometry to one O2- atom. The Hg–O bond length is 2.18 Å. There are five inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a distorted linear geometry to two O2- atoms. There is one shorter (1.01 Å) and one longer (1.64 Å) H–O bond length. In the second H1+ site, H1+ is bonded in a single-bondmore »« less

Similar Records