Journal of the American Chemical Society
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ASSOCIATED CONTENT
Supporting Information. XRD patterns, BET measurement data
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AUTHOR INFORMATION
Corresponding Author
* Johannes A. Lercher; Johannes.Lercher@pnnl.gov
Present Addresses
Institute for Integrated Catalysis, Pacific Northwest National La-
boratory, P.O. Box 999, Richland, WA 99352 (United States).
Author Contributions
The manuscript was written through contributions of all authors.
ACKNOWLEDGMENT
Authors thank B. W. Arey (PNNL) for HIM measurements, T.
Huthwelker for support during Al XAFS measurements at the
Swiss Light Source (PSI, Switzerland), J. Z. Hu and S. D. Burton
(PNNL) for support during NMR experiments. This work was
supported by the U. S. Department of Energy (DOE), Office of
Science, Office of Basic Energy Sciences, Division of Chemical
Sciences, Geosciences & Biosciences. MD acknowledges support
by the Materials Synthesis and Simulation Across Scales (MS3
Initiative) conducted under Laboratory Directed Research & De-
velopment Program at PNNL. NMR experiments were performed
at the Environmental Molecular Science Laboratory, a national
scientific user facility sponsored by the DOE Office of Science,
Office of Biological and Environmental Research, and Physical
Science Laboratory both located at Pacific Northwest National
Laboratory (PNNL).
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ABBREVIATIONS
DFT, density functional calculations; EXAFS, extended X-ray
absorption fine structure spectroscopy; XANES, X-ray absorption
near edge spectroscopy; MAS, magic angle spinning; NMR, nu-
clear magnetic resonance; MD, molecular dynamics; HDO, hy-
drodeoxygenation; XAFS, X-ray absorption spectroscopy; XSW,
X-ray standing wave; XRD, X-ray diffraction; TPD, Temperature
programed desorption.
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