Materials Data on Sr(AsO4)2 by Materials Project

doi:10.17188/1652872

Title: Materials Data on Sr(AsO4)2 by Materials Project

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Abstract

Sr(AsO4)2 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. Sr is bonded in a 6-coordinate geometry to eight O atoms. There are a spread of Sr–O bond distances ranging from 2.41–3.21 Å. There are two inequivalent As sites. In the first As site, As is bonded in a rectangular see-saw-like geometry to four O atoms. There are a spread of As–O bond distances ranging from 1.64–1.88 Å. In the second As site, As is bonded in a tetrahedral geometry to four O atoms. There are a spread of As–O bond distances ranging from 1.66–1.87 Å. There are eight inequivalent O sites. In the first O site, O is bonded in a distorted trigonal planar geometry to two equivalent Sr and one As atom. In the second O site, O is bonded in a distorted single-bond geometry to one Sr, one As, and one O atom. The O–O bond length is 1.48 Å. In the third O site, O is bonded in a single-bond geometry to one As atom. In the fourth O site, O is bonded in a 1-coordinate geometry to one Sr, one As, and one O atom. In the fifth O site, O is bondedmore »« less

Authors:: The Materials Project

Publication Date:: Sat Jul 18 00:00:00 EDT 2020

Other Number(s):: mp-1179360

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; Sr(AsO4)2; As-O-Sr

OSTI Identifier:: 1652872

DOI:: https://doi.org/10.17188/1652872

Citation Formats


                    The Materials Project. Materials Data on Sr(AsO4)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1652872.

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                    The Materials Project. Materials Data on Sr(AsO4)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1652872

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                    The Materials Project. 2020.  
"Materials Data on Sr(AsO4)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1652872.  https://www.osti.gov/servlets/purl/1652872. Pub date:Sat Jul 18 00:00:00 EDT 2020

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@article{osti_1652872,

  title        = {Materials Data on Sr(AsO4)2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Sr(AsO4)2 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. Sr is bonded in a 6-coordinate geometry to eight O atoms. There are a spread of Sr–O bond distances ranging from 2.41–3.21 Å. There are two inequivalent As sites. In the first As site, As is bonded in a rectangular see-saw-like geometry to four O atoms. There are a spread of As–O bond distances ranging from 1.64–1.88 Å. In the second As site, As is bonded in a tetrahedral geometry to four O atoms. There are a spread of As–O bond distances ranging from 1.66–1.87 Å. There are eight inequivalent O sites. In the first O site, O is bonded in a distorted trigonal planar geometry to two equivalent Sr and one As atom. In the second O site, O is bonded in a distorted single-bond geometry to one Sr, one As, and one O atom. The O–O bond length is 1.48 Å. In the third O site, O is bonded in a single-bond geometry to one As atom. In the fourth O site, O is bonded in a 1-coordinate geometry to one Sr, one As, and one O atom. In the fifth O site, O is bonded in a 1-coordinate geometry to one Sr, one As, and one O atom. The O–O bond length is 1.49 Å. In the sixth O site, O is bonded in a distorted trigonal planar geometry to two equivalent Sr and one As atom. In the seventh O site, O is bonded in a distorted bent 150 degrees geometry to one Sr and one As atom. In the eighth O site, O is bonded in a distorted single-bond geometry to one As atom.},

  doi          = {10.17188/1652872},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat Jul 18 00:00:00 EDT 2020},

  month        = {Sat Jul 18 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1652872

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