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Title: Materials Data on P2PbAu2 by Materials Project

Abstract

Au2PbP2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Au2+ sites. In the first Au2+ site, Au2+ is bonded in a linear geometry to two equivalent P3- atoms. Both Au–P bond lengths are 2.38 Å. In the second Au2+ site, Au2+ is bonded in a distorted T-shaped geometry to one Pb2+ and two equivalent P3- atoms. The Au–Pb bond length is 2.93 Å. Both Au–P bond lengths are 2.36 Å. Pb2+ is bonded in a single-bond geometry to one Au2+ atom. P3- is bonded to two Au2+ and two equivalent P3- atoms to form corner-sharing PP2Au2 tetrahedra. Both P–P bond lengths are 2.23 Å.

Publication Date:
Other Number(s):
mp-30108
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
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)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; P2PbAu2; Au-P-Pb
OSTI Identifier:
1204533
DOI:
https://doi.org/10.17188/1204533

Citation Formats

The Materials Project. Materials Data on P2PbAu2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1204533.
The Materials Project. Materials Data on P2PbAu2 by Materials Project. United States. doi:https://doi.org/10.17188/1204533
The Materials Project. 2020. "Materials Data on P2PbAu2 by Materials Project". United States. doi:https://doi.org/10.17188/1204533. https://www.osti.gov/servlets/purl/1204533. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1204533,
title = {Materials Data on P2PbAu2 by Materials Project},
author = {The Materials Project},
abstractNote = {Au2PbP2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Au2+ sites. In the first Au2+ site, Au2+ is bonded in a linear geometry to two equivalent P3- atoms. Both Au–P bond lengths are 2.38 Å. In the second Au2+ site, Au2+ is bonded in a distorted T-shaped geometry to one Pb2+ and two equivalent P3- atoms. The Au–Pb bond length is 2.93 Å. Both Au–P bond lengths are 2.36 Å. Pb2+ is bonded in a single-bond geometry to one Au2+ atom. P3- is bonded to two Au2+ and two equivalent P3- atoms to form corner-sharing PP2Au2 tetrahedra. Both P–P bond lengths are 2.23 Å.},
doi = {10.17188/1204533},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}