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Title: Materials Data on AgP15 by Materials Project

Abstract

AgP15 crystallizes in the triclinic P-1 space group. The structure is two-dimensional and consists of one AgP15 sheet oriented in the (0, 0, 1) direction. Ag1+ is bonded to four P+0.07- atoms to form distorted AgP4 trigonal pyramids that share corners with three PAgP3 trigonal pyramids. There are a spread of Ag–P bond distances ranging from 2.51–2.97 Å. There are fifteen inequivalent P+0.07- sites. In the first P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to three P+0.07- atoms. There are a spread of P–P bond distances ranging from 2.17–2.24 Å. In the second P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to three P+0.07- atoms. There are two shorter (2.20 Å) and one longer (2.27 Å) P–P bond lengths. In the third P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to three P+0.07- atoms. There are one shorter (2.20 Å) and one longer (2.32 Å) P–P bond lengths. In the fourth P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to one Ag1+ and two P+0.07- atoms. The P–P bond length is 2.19 Å. In the fifth P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to three P+0.07- atoms. Theremore » are one shorter (2.22 Å) and one longer (2.26 Å) P–P bond lengths. In the sixth P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to three P+0.07- atoms. There are one shorter (2.21 Å) and one longer (2.24 Å) P–P bond lengths. In the seventh P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to three P+0.07- atoms. There are one shorter (2.20 Å) and one longer (2.25 Å) P–P bond lengths. In the eighth P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to three P+0.07- atoms. There are one shorter (2.21 Å) and one longer (2.22 Å) P–P bond lengths. In the ninth P+0.07- site, P+0.07- is bonded to one Ag1+ and three P+0.07- atoms to form PAgP3 trigonal pyramids that share a cornercorner with one AgP4 trigonal pyramid and corners with two PAgP3 trigonal pyramids. The P–P bond length is 2.23 Å. In the tenth P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to three P+0.07- atoms. The P–P bond length is 2.23 Å. In the eleventh P+0.07- site, P+0.07- is bonded to one Ag1+ and three P+0.07- atoms to form distorted PAgP3 trigonal pyramids that share a cornercorner with one AgP4 trigonal pyramid and corners with two PAgP3 trigonal pyramids. The P–P bond length is 2.32 Å. In the twelfth P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to three P+0.07- atoms. In the thirteenth P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to three P+0.07- atoms. There are one shorter (2.21 Å) and one longer (2.25 Å) P–P bond lengths. In the fourteenth P+0.07- site, P+0.07- is bonded to one Ag1+ and three P+0.07- atoms to form distorted PAgP3 trigonal pyramids that share a cornercorner with one AgP4 trigonal pyramid and corners with two PAgP3 trigonal pyramids. In the fifteenth P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to three P+0.07- atoms.« less

Authors:
Publication Date:
Other Number(s):
mp-1195243
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; AgP15; Ag-P
OSTI Identifier:
1684068
DOI:
https://doi.org/10.17188/1684068

Citation Formats

The Materials Project. Materials Data on AgP15 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1684068.
The Materials Project. Materials Data on AgP15 by Materials Project. United States. doi:https://doi.org/10.17188/1684068
The Materials Project. 2020. "Materials Data on AgP15 by Materials Project". United States. doi:https://doi.org/10.17188/1684068. https://www.osti.gov/servlets/purl/1684068. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1684068,
title = {Materials Data on AgP15 by Materials Project},
author = {The Materials Project},
abstractNote = {AgP15 crystallizes in the triclinic P-1 space group. The structure is two-dimensional and consists of one AgP15 sheet oriented in the (0, 0, 1) direction. Ag1+ is bonded to four P+0.07- atoms to form distorted AgP4 trigonal pyramids that share corners with three PAgP3 trigonal pyramids. There are a spread of Ag–P bond distances ranging from 2.51–2.97 Å. There are fifteen inequivalent P+0.07- sites. In the first P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to three P+0.07- atoms. There are a spread of P–P bond distances ranging from 2.17–2.24 Å. In the second P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to three P+0.07- atoms. There are two shorter (2.20 Å) and one longer (2.27 Å) P–P bond lengths. In the third P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to three P+0.07- atoms. There are one shorter (2.20 Å) and one longer (2.32 Å) P–P bond lengths. In the fourth P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to one Ag1+ and two P+0.07- atoms. The P–P bond length is 2.19 Å. In the fifth P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to three P+0.07- atoms. There are one shorter (2.22 Å) and one longer (2.26 Å) P–P bond lengths. In the sixth P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to three P+0.07- atoms. There are one shorter (2.21 Å) and one longer (2.24 Å) P–P bond lengths. In the seventh P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to three P+0.07- atoms. There are one shorter (2.20 Å) and one longer (2.25 Å) P–P bond lengths. In the eighth P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to three P+0.07- atoms. There are one shorter (2.21 Å) and one longer (2.22 Å) P–P bond lengths. In the ninth P+0.07- site, P+0.07- is bonded to one Ag1+ and three P+0.07- atoms to form PAgP3 trigonal pyramids that share a cornercorner with one AgP4 trigonal pyramid and corners with two PAgP3 trigonal pyramids. The P–P bond length is 2.23 Å. In the tenth P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to three P+0.07- atoms. The P–P bond length is 2.23 Å. In the eleventh P+0.07- site, P+0.07- is bonded to one Ag1+ and three P+0.07- atoms to form distorted PAgP3 trigonal pyramids that share a cornercorner with one AgP4 trigonal pyramid and corners with two PAgP3 trigonal pyramids. The P–P bond length is 2.32 Å. In the twelfth P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to three P+0.07- atoms. In the thirteenth P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to three P+0.07- atoms. There are one shorter (2.21 Å) and one longer (2.25 Å) P–P bond lengths. In the fourteenth P+0.07- site, P+0.07- is bonded to one Ag1+ and three P+0.07- atoms to form distorted PAgP3 trigonal pyramids that share a cornercorner with one AgP4 trigonal pyramid and corners with two PAgP3 trigonal pyramids. In the fifteenth P+0.07- site, P+0.07- is bonded in a trigonal non-coplanar geometry to three P+0.07- atoms.},
doi = {10.17188/1684068},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}