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Title: Materials Data on PaV by Materials Project

Abstract

PaV crystallizes in the monoclinic Pm space group. The structure is three-dimensional. Pa is bonded to six equivalent Pa and six equivalent V atoms to form distorted PaPa6V6 cuboctahedra that share corners with eighteen equivalent PaPa6V6 cuboctahedra, edges with six equivalent PaPa6V6 cuboctahedra, edges with twelve equivalent VPa6V6 cuboctahedra, faces with eight equivalent PaPa6V6 cuboctahedra, and faces with twelve equivalent VPa6V6 cuboctahedra. There are a spread of Pa–Pa bond distances ranging from 3.05–3.08 Å. There are a spread of Pa–V bond distances ranging from 2.92–2.97 Å. V is bonded to six equivalent Pa and six equivalent V atoms to form distorted VPa6V6 cuboctahedra that share corners with eighteen equivalent VPa6V6 cuboctahedra, edges with six equivalent VPa6V6 cuboctahedra, edges with twelve equivalent PaPa6V6 cuboctahedra, faces with eight equivalent VPa6V6 cuboctahedra, and faces with twelve equivalent PaPa6V6 cuboctahedra. There are a spread of V–V bond distances ranging from 3.05–3.08 Å.

Publication Date:
Other Number(s):
mp-1186449
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; PaV; Pa-V
OSTI Identifier:
1686585
DOI:
https://doi.org/10.17188/1686585

Citation Formats

The Materials Project. Materials Data on PaV by Materials Project. United States: N. p., 2019. Web. doi:10.17188/1686585.
The Materials Project. Materials Data on PaV by Materials Project. United States. doi:https://doi.org/10.17188/1686585
The Materials Project. 2019. "Materials Data on PaV by Materials Project". United States. doi:https://doi.org/10.17188/1686585. https://www.osti.gov/servlets/purl/1686585. Pub date:Fri Jan 11 00:00:00 EST 2019
@article{osti_1686585,
title = {Materials Data on PaV by Materials Project},
author = {The Materials Project},
abstractNote = {PaV crystallizes in the monoclinic Pm space group. The structure is three-dimensional. Pa is bonded to six equivalent Pa and six equivalent V atoms to form distorted PaPa6V6 cuboctahedra that share corners with eighteen equivalent PaPa6V6 cuboctahedra, edges with six equivalent PaPa6V6 cuboctahedra, edges with twelve equivalent VPa6V6 cuboctahedra, faces with eight equivalent PaPa6V6 cuboctahedra, and faces with twelve equivalent VPa6V6 cuboctahedra. There are a spread of Pa–Pa bond distances ranging from 3.05–3.08 Å. There are a spread of Pa–V bond distances ranging from 2.92–2.97 Å. V is bonded to six equivalent Pa and six equivalent V atoms to form distorted VPa6V6 cuboctahedra that share corners with eighteen equivalent VPa6V6 cuboctahedra, edges with six equivalent VPa6V6 cuboctahedra, edges with twelve equivalent PaPa6V6 cuboctahedra, faces with eight equivalent VPa6V6 cuboctahedra, and faces with twelve equivalent PaPa6V6 cuboctahedra. There are a spread of V–V bond distances ranging from 3.05–3.08 Å.},
doi = {10.17188/1686585},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}