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Title: Unraveling the Hydrogenation of TiO 2 and Graphene Oxide/TiO 2 Composites in Real Time by in Situ Synchrotron X-ray Powder Diffraction and Pair Distribution Function Analysis

Abstract

The functionalization of graphene oxide (GO) and graphene by TiO 2 and other metal oxides has attracted considerable attention due to numerous promising applications in catalysis, energy conversion, and storage. We propose hydrogenation of this class of materials as a promising way to tune catalytic properties by altering the structural and chemical transformations that occur upon H incorporation. We also investigate the structural changes that occur during the hydrogenation process using in situ powder X-ray diffraction and pair distribution function analysis of GO–TiO 2 and TiO 2 under H 2 reduction. Sequential Rietveld refinement was employed to gain insight into the evolution of crystal growth of TiO 2 nanoparticles in the presence of two-dimensional (2D) GO nanosheets. GO sheets not only significantly retarded the nucleation and growth of rutile impurities, stabilizing the anatase structure, but was also partially reduced to hydrogenated graphene by the introduction of atomic hydrogen into the honeycomb lattice. We discuss the hydrogenation processes and the resulting composite structure that occurs during the incorporation of atomic H and the dynamic structural transformations that leads to a highly active photocatalyst.

Authors:
 [1];  [2];  [2];  [1];  [2];  [1];  [1];  [1];  [1];  [2];  [1]
  1. Brookhaven National Lab. (BNL), Upton, NY (United States)
  2. Brookhaven National Lab. (BNL), Upton, NY (United States); Stony Brook Univ., NY (United States)
Publication Date:
Research Org.:
Brookhaven National Laboratory (BNL), Upton, NY (United States)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
OSTI Identifier:
1248809
Report Number(s):
BNL-112079-2016-JA
Journal ID: ISSN 1932-7447; R&D Project: CO009; CO026; KC0302010; KC0304030
Grant/Contract Number:  
SC00112704
Resource Type:
Journal Article: Accepted Manuscript
Journal Name:
Journal of Physical Chemistry. C
Additional Journal Information:
Journal Volume: 120; Journal Issue: 6; Journal ID: ISSN 1932-7447
Publisher:
American Chemical Society
Country of Publication:
United States
Language:
English
Subject:
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY

Citation Formats

Nguyen-Phan, Thuy-Duong, Liu, Zongyuan, Luo, Si, Gamalski, Andrew D., Vovchok, Dimitry, Xu, Wenqian, Stach, Eric A., Polyansky, Dmitry E., Fujita, Etsuko, Rodriguez, José A., and Senanayake, Sanjaya D. Unraveling the Hydrogenation of TiO 2 and Graphene Oxide/TiO 2 Composites in Real Time by in Situ Synchrotron X-ray Powder Diffraction and Pair Distribution Function Analysis. United States: N. p., 2016. Web. doi:10.1021/acs.jpcc.5b09504.
Nguyen-Phan, Thuy-Duong, Liu, Zongyuan, Luo, Si, Gamalski, Andrew D., Vovchok, Dimitry, Xu, Wenqian, Stach, Eric A., Polyansky, Dmitry E., Fujita, Etsuko, Rodriguez, José A., & Senanayake, Sanjaya D. Unraveling the Hydrogenation of TiO 2 and Graphene Oxide/TiO 2 Composites in Real Time by in Situ Synchrotron X-ray Powder Diffraction and Pair Distribution Function Analysis. United States. doi:10.1021/acs.jpcc.5b09504.
Nguyen-Phan, Thuy-Duong, Liu, Zongyuan, Luo, Si, Gamalski, Andrew D., Vovchok, Dimitry, Xu, Wenqian, Stach, Eric A., Polyansky, Dmitry E., Fujita, Etsuko, Rodriguez, José A., and Senanayake, Sanjaya D. Thu . "Unraveling the Hydrogenation of TiO 2 and Graphene Oxide/TiO 2 Composites in Real Time by in Situ Synchrotron X-ray Powder Diffraction and Pair Distribution Function Analysis". United States. doi:10.1021/acs.jpcc.5b09504. https://www.osti.gov/servlets/purl/1248809.
@article{osti_1248809,
title = {Unraveling the Hydrogenation of TiO 2 and Graphene Oxide/TiO 2 Composites in Real Time by in Situ Synchrotron X-ray Powder Diffraction and Pair Distribution Function Analysis},
author = {Nguyen-Phan, Thuy-Duong and Liu, Zongyuan and Luo, Si and Gamalski, Andrew D. and Vovchok, Dimitry and Xu, Wenqian and Stach, Eric A. and Polyansky, Dmitry E. and Fujita, Etsuko and Rodriguez, José A. and Senanayake, Sanjaya D.},
abstractNote = {The functionalization of graphene oxide (GO) and graphene by TiO2 and other metal oxides has attracted considerable attention due to numerous promising applications in catalysis, energy conversion, and storage. We propose hydrogenation of this class of materials as a promising way to tune catalytic properties by altering the structural and chemical transformations that occur upon H incorporation. We also investigate the structural changes that occur during the hydrogenation process using in situ powder X-ray diffraction and pair distribution function analysis of GO–TiO2 and TiO2 under H2 reduction. Sequential Rietveld refinement was employed to gain insight into the evolution of crystal growth of TiO2 nanoparticles in the presence of two-dimensional (2D) GO nanosheets. GO sheets not only significantly retarded the nucleation and growth of rutile impurities, stabilizing the anatase structure, but was also partially reduced to hydrogenated graphene by the introduction of atomic hydrogen into the honeycomb lattice. We discuss the hydrogenation processes and the resulting composite structure that occurs during the incorporation of atomic H and the dynamic structural transformations that leads to a highly active photocatalyst.},
doi = {10.1021/acs.jpcc.5b09504},
journal = {Journal of Physical Chemistry. C},
issn = {1932-7447},
number = 6,
volume = 120,
place = {United States},
year = {2016},
month = {2}
}

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