How Accurately Can Extended X-ray Absorption Spectra Be Predicted from First Principles? Implications for Modeling the Oxygen-Evolving Complex in Photosystem II
- Authors:
- Publication Date:
- Research Org.:
- Lawrence Livermore National Laboratory (LLNL), Livermore, CA (United States)
- Sponsoring Org.:
- USDOE
- OSTI Identifier:
- 1249121
- Report Number(s):
- LLNL-JRNL-651665
Journal ID: ISSN 0002-7863
- DOE Contract Number:
- AC52-07NA27344
- Resource Type:
- Journal Article
- Journal Name:
- Journal of the American Chemical Society
- Additional Journal Information:
- Journal Volume: 137; Journal Issue: 40; Journal ID: ISSN 0002-7863
- Publisher:
- American Chemical Society (ACS)
- Country of Publication:
- United States
- Language:
- English
- Subject:
- 37 INORGANIC, ORGANIC, PHYSICAL AND ANALYTICAL CHEMISTRY
Citation Formats
Beckwith, Martha A., Ames, William, Vila, Fernando D., Krewald, Vera, Pantazis, Dimitrios A., Mantel, Claire, Pécaut, Jacques, Gennari, Marcello, Duboc, Carole, Collomb, Marie-Noëlle, Yano, Junko, Rehr, John J., Neese, Frank, and DeBeer, Serena. How Accurately Can Extended X-ray Absorption Spectra Be Predicted from First Principles? Implications for Modeling the Oxygen-Evolving Complex in Photosystem II. United States: N. p., 2015.
Web. doi:10.1021/jacs.5b00783.
Beckwith, Martha A., Ames, William, Vila, Fernando D., Krewald, Vera, Pantazis, Dimitrios A., Mantel, Claire, Pécaut, Jacques, Gennari, Marcello, Duboc, Carole, Collomb, Marie-Noëlle, Yano, Junko, Rehr, John J., Neese, Frank, & DeBeer, Serena. How Accurately Can Extended X-ray Absorption Spectra Be Predicted from First Principles? Implications for Modeling the Oxygen-Evolving Complex in Photosystem II. United States. https://doi.org/10.1021/jacs.5b00783
Beckwith, Martha A., Ames, William, Vila, Fernando D., Krewald, Vera, Pantazis, Dimitrios A., Mantel, Claire, Pécaut, Jacques, Gennari, Marcello, Duboc, Carole, Collomb, Marie-Noëlle, Yano, Junko, Rehr, John J., Neese, Frank, and DeBeer, Serena. 2015.
"How Accurately Can Extended X-ray Absorption Spectra Be Predicted from First Principles? Implications for Modeling the Oxygen-Evolving Complex in Photosystem II". United States. https://doi.org/10.1021/jacs.5b00783. https://www.osti.gov/servlets/purl/1249121.
@article{osti_1249121,
title = {How Accurately Can Extended X-ray Absorption Spectra Be Predicted from First Principles? Implications for Modeling the Oxygen-Evolving Complex in Photosystem II},
author = {Beckwith, Martha A. and Ames, William and Vila, Fernando D. and Krewald, Vera and Pantazis, Dimitrios A. and Mantel, Claire and Pécaut, Jacques and Gennari, Marcello and Duboc, Carole and Collomb, Marie-Noëlle and Yano, Junko and Rehr, John J. and Neese, Frank and DeBeer, Serena},
abstractNote = {},
doi = {10.1021/jacs.5b00783},
url = {https://www.osti.gov/biblio/1249121},
journal = {Journal of the American Chemical Society},
issn = {0002-7863},
number = 40,
volume = 137,
place = {United States},
year = {Wed Oct 14 00:00:00 EDT 2015},
month = {Wed Oct 14 00:00:00 EDT 2015}
}
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Works referencing / citing this record:
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