U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on MoPCl5O3 (SG:14) by Materials Project
Abstract
Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
- Authors:
- Publication Date:
- Other Number(s):
- mp-567661
- 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; Cl5 Mo1 O3 P1; Cl-Mo-O-P; ICSD-32649; electronic bandstructure
- OSTI Identifier:
- 1273980
- DOI:
- https://doi.org/10.17188/1273980
Citation Formats
The Materials Project. Materials Data on MoPCl5O3 (SG:14) by Materials Project. United States: N. p., 2016.
Web. doi:10.17188/1273980.
The Materials Project. Materials Data on MoPCl5O3 (SG:14) by Materials Project. United States. doi:https://doi.org/10.17188/1273980
The Materials Project. 2016.
"Materials Data on MoPCl5O3 (SG:14) by Materials Project". United States. doi:https://doi.org/10.17188/1273980. https://www.osti.gov/servlets/purl/1273980. Pub date:Thu Feb 04 00:00:00 EST 2016
@article{osti_1273980,
title = {Materials Data on MoPCl5O3 (SG:14) by Materials Project},
author = {The Materials Project},
abstractNote = {Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations},
doi = {10.17188/1273980},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2016},
month = {2}
}
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