Materials Data on V5S4 by Materials Project

doi:10.17188/1187743

Title: Materials Data on V5S4 by Materials Project

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Abstract

V5S4 is Titanium telluride structured and crystallizes in the tetragonal I4/m space group. The structure is three-dimensional. there are two inequivalent V sites. In the first V site, V is bonded to five equivalent S atoms to form a mixture of distorted corner and edge-sharing VS5 square pyramids. There are a spread of V–S bond distances ranging from 2.33–2.41 Å. In the second V site, V is bonded in a distorted square co-planar geometry to four equivalent S atoms. All V–S bond lengths are 2.51 Å. S is bonded in a 6-coordinate geometry to six V atoms.

Authors:: The Materials Project

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

Other Number(s):: mp-1133

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; V5S4; S-V

OSTI Identifier:: 1187743

DOI:: https://doi.org/10.17188/1187743

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                    The Materials Project. Materials Data on V5S4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1187743.

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                    The Materials Project. Materials Data on V5S4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1187743

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                    The Materials Project. 2020.  
"Materials Data on V5S4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1187743.  https://www.osti.gov/servlets/purl/1187743. Pub date:Thu Jul 16 00:00:00 EDT 2020

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@article{osti_1187743,

  title        = {Materials Data on V5S4 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {V5S4 is Titanium telluride structured and crystallizes in the tetragonal I4/m space group. The structure is three-dimensional. there are two inequivalent V sites. In the first V site, V is bonded to five equivalent S atoms to form a mixture of distorted corner and edge-sharing VS5 square pyramids. There are a spread of V–S bond distances ranging from 2.33–2.41 Å. In the second V site, V is bonded in a distorted square co-planar geometry to four equivalent S atoms. All V–S bond lengths are 2.51 Å. S is bonded in a 6-coordinate geometry to six V atoms.},

  doi          = {10.17188/1187743},

  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/10.17188/1187743

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