Materials Data on Ge3Mo5 by Materials Project

doi:10.17188/1192328

Title: Materials Data on Ge3Mo5 by Materials Project

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Abstract

Mo5Ge3 crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. there are two inequivalent Mo sites. In the first Mo site, Mo is bonded in a 7-coordinate geometry to six Ge atoms. There are a spread of Mo–Ge bond distances ranging from 2.60–2.85 Å. In the second Mo site, Mo is bonded in a 6-coordinate geometry to two equivalent Mo and four equivalent Ge atoms. Both Mo–Mo bond lengths are 2.50 Å. All Mo–Ge bond lengths are 2.67 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a distorted q6 geometry to eight equivalent Mo and two equivalent Ge atoms. Both Ge–Ge bond lengths are 2.50 Å. In the second Ge site, Ge is bonded in a 10-coordinate geometry to ten Mo atoms.

Authors:: The Materials Project

Publication Date:: Sat May 02 00:00:00 EDT 2020

Other Number(s):: mp-17094

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; Ge3Mo5; Ge-Mo

OSTI Identifier:: 1192328

DOI:: https://doi.org/10.17188/1192328

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                    The Materials Project. Materials Data on Ge3Mo5 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1192328.

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                    The Materials Project. Materials Data on Ge3Mo5 by Materials Project.  United States.  doi:https://doi.org/10.17188/1192328

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                    The Materials Project. 2020.  
"Materials Data on Ge3Mo5 by Materials Project".  United States.  doi:https://doi.org/10.17188/1192328.  https://www.osti.gov/servlets/purl/1192328. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1192328,

  title        = {Materials Data on Ge3Mo5 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Mo5Ge3 crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. there are two inequivalent Mo sites. In the first Mo site, Mo is bonded in a 7-coordinate geometry to six Ge atoms. There are a spread of Mo–Ge bond distances ranging from 2.60–2.85 Å. In the second Mo site, Mo is bonded in a 6-coordinate geometry to two equivalent Mo and four equivalent Ge atoms. Both Mo–Mo bond lengths are 2.50 Å. All Mo–Ge bond lengths are 2.67 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a distorted q6 geometry to eight equivalent Mo and two equivalent Ge atoms. Both Ge–Ge bond lengths are 2.50 Å. In the second Ge site, Ge is bonded in a 10-coordinate geometry to ten Mo atoms.},

  doi          = {10.17188/1192328},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat May 02 00:00:00 EDT 2020},

  month        = {Sat May 02 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1192328

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