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Title: Materials Data on H2O by Materials Project

Abstract

H2O is Tungsten-like structured and crystallizes in the tetragonal I4_1/amd space group. The structure is zero-dimensional and consists of eight water molecules. H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.99 Å. O2- is bonded in a water-like geometry to two equivalent H1+ atoms.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-697085
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; H2O; H-O
OSTI Identifier:
1285104
DOI:
10.17188/1285104

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on H2O by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1285104.
Persson, Kristin, & Project, Materials. Materials Data on H2O by Materials Project. United States. doi:10.17188/1285104.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on H2O by Materials Project". United States. doi:10.17188/1285104. https://www.osti.gov/servlets/purl/1285104. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1285104,
title = {Materials Data on H2O by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {H2O is Tungsten-like structured and crystallizes in the tetragonal I4_1/amd space group. The structure is zero-dimensional and consists of eight water molecules. H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.99 Å. O2- is bonded in a water-like geometry to two equivalent H1+ atoms.},
doi = {10.17188/1285104},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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