Materials Data on Ag3Te(AsO7)2 by Materials Project

Abstract

Ag3Te(AsO7)2 crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are six inequivalent Ag sites. In the first Ag site, Ag is bonded in a 5-coordinate geometry to five O atoms. There are a spread of Ag–O bond distances ranging from 2.03–2.68 Å. In the second Ag site, Ag is bonded in a see-saw-like geometry to four O atoms. There are a spread of Ag–O bond distances ranging from 2.10–2.24 Å. In the third Ag site, Ag is bonded in a 5-coordinate geometry to five O atoms. There are a spread of Ag–O bond distances ranging from 2.03–2.69 Å. In the fourth Ag site, Ag is bonded in a see-saw-like geometry to four O atoms. There are two shorter (2.10 Å) and two longer (2.23 Å) Ag–O bond lengths. In the fifth Ag site, Ag is bonded in a distorted rectangular see-saw-like geometry to four O atoms. There are a spread of Ag–O bond distances ranging from 2.03–2.18 Å. In the sixth Ag site, Ag is bonded in a distorted rectangular see-saw-like geometry to four O atoms. There are a spread of Ag–O bond distances ranging from 2.03–2.17 Å. There are four inequivalent As sites. In the first As site, As is bonded in a tetrahedral geometry to four O atoms. There are a spread of As–O bond distances ranging from 1.70–1.80 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 1.70–1.79 Å. In the third As site, As is bonded in a tetrahedral geometry to four O atoms. There are a spread of As–O bond distances ranging from 1.70–1.80 Å. In the fourth As site, As is bonded in a tetrahedral geometry to four O atoms. There are a spread of As–O bond distances ranging from 1.70–1.80 Å. There are two inequivalent Te sites. In the first Te site, Te is bonded in a distorted octahedral geometry to six O atoms. There are a spread of Te–O bond distances ranging from 1.93–1.99 Å. In the second Te site, Te is bonded in an octahedral geometry to six O atoms. There are a spread of Te–O bond distances ranging from 1.93–1.99 Å. There are twenty-eight inequivalent O sites. In the first O site, O is bonded in a 3-coordinate geometry to two Ag and one As atom. In the second O site, O is bonded in a 3-coordinate geometry to two Ag and one As atom. In the third O site, O is bonded in a 3-coordinate geometry to two Ag and one As atom. In the fourth O site, O is bonded in a 3-coordinate geometry to two Ag and one As atom. In the fifth O site, O is bonded in a single-bond geometry to one Te atom. In the sixth O site, O is bonded in a distorted bent 120 degrees geometry to one Ag and one Te atom. In the seventh O site, O is bonded in a single-bond geometry to one Te atom. In the eighth O site, O is bonded in a single-bond geometry to one Te atom. In the ninth O site, O is bonded in a distorted bent 150 degrees geometry to one Ag and one Te atom. In the tenth O site, O is bonded in a distorted bent 120 degrees geometry to one Ag and one Te atom. In the eleventh O site, O is bonded in a distorted bent 150 degrees geometry to one Ag and one Te atom. In the twelfth O site, O is bonded in a single-bond geometry to one Te atom. In the thirteenth O site, O is bonded in a distorted bent 150 degrees geometry to one Ag and one Te atom. In the fourteenth O site, O is bonded in a distorted bent 150 degrees geometry to one Ag and one Te atom. In the fifteenth O site, O is bonded in a single-bond geometry to one Te atom. In the sixteenth O site, O is bonded in a single-bond geometry to one Te atom. In the seventeenth O site, O is bonded in a bent 120 degrees geometry to one Ag and one As atom. In the eighteenth O site, O is bonded in a bent 120 degrees geometry to one Ag and one As atom. In the nineteenth O site, O is bonded in a bent 120 degrees geometry to one Ag and one As atom. In the twentieth O site, O is bonded in a bent 120 degrees geometry to one Ag and one As atom. In the twenty-first O site, O is bonded in a bent 120 degrees geometry to one Ag and one As atom. In the twenty-second O site, O is bonded in a bent 120 degrees geometry to one Ag and one As atom. In the twenty-third O site, O is bonded in a bent 120 degrees geometry to one Ag and one As atom. In the twenty-fourth O site, O is bonded in a bent 120 degrees geometry to one Ag and one As atom. In the twenty-fifth O site, O is bonded in a bent 120 degrees geometry to one Ag and one As atom. In the twenty-sixth O site, O is bonded in a bent 120 degrees geometry to one Ag and one As atom. In the twenty-seventh O site, O is bonded in a bent 120 degrees geometry to one Ag and one As atom. In the twenty-eighth O site, O is bonded in a bent 120 degrees geometry to one Ag and one As atom.