Polarization-driven catalysis via ferroelectric oxide surfaces

2016 ◽  
Vol 18 (29) ◽  
pp. 19676-19695 ◽  
Author(s):  
Arvin Kakekhani ◽  
Sohrab Ismail-Beigi
Keyword(s):  
Surface Chemistry ◽  
Direct Decomposition ◽  
Catalytic Reactions ◽  
Ferroelectric Polarization ◽  
Oxide Surfaces ◽  
Ferroelectric Oxide

Ferroelectric polarization can tune the surface chemistry: enhancing technologically important catalytic reactions such as NOx direct decomposition and SO2 oxidation.

ChemInform Abstract: Role of Hot Electrons and Metal-Oxide Interfaces in Surface Chemistry and Catalytic Reactions

ChemInform ◽  
2015 ◽  
Vol 46 (23) ◽  
pp. no-no
Author(s):  
Jeong Young Park ◽  
L. Robert Baker ◽  
Gabor A. Somorjai
Keyword(s):  
Metal Oxide ◽  
Surface Chemistry ◽  
Catalytic Reactions ◽  
Hot Electrons ◽  
Oxide Interfaces

scholarly journals Integrated Experimental-Theoretical Approach to Determine Reliable Molecular Reaction Mechanisms on Transition Metal Oxide Surfaces

2018 ◽  
Author(s):  
Nickolas Ashburn ◽  
yongping zheng ◽  
Sampreetha Thampy ◽  
Sean Dillon ◽  
Yves Chabal ◽  
...  
Keyword(s):  
Metal Oxide ◽  
Surface Chemistry ◽  
Density Functional ◽  
High Reliability ◽  
Quantitative Relationship ◽  
No Oxidation ◽  
Oxide Surfaces ◽  
Metal Oxide Surfaces ◽  
Theoretical Approaches ◽  
Gas Surface Interactions

<p>By combining experimental and theoretical approaches, we investigate the quantitative relationship between molecular desorption temperature and binding energy on <i>d</i> and <i>f</i> metal oxide surfaces. We demonstrate how temperature programmed desorption (TPD) can be used to quantitatively correlate the theoretical surface chemistry of metal oxides (via on-site Hubbard U correction) to gas surface interactions for catalytic reactions. For this purpose, both CO and NO oxidation mechanisms are studied in a step by step reaction process for perovskite and mullite-type oxides, respectively. Additionally, we show solutions for over-binding issues found in CO<sub>x</sub>, NO<sub>x</sub>, SO<sub>x</sub>, and other covalently bonded molecules which must be considered during surface reaction modeling. This work shows the high reliability of using TPD and density functional theory (DFT) in conjunction to create accurate surface chemistry information for a variety of correlated metal oxide materials.</p>

scholarly journals Surface chemistry of rare-earth oxide surfaces at ambient conditions: reactions with water and hydrocarbons

2017 ◽  
Vol 7 (1) ◽  
Author(s):  
Elçin Külah ◽  
Laurent Marot ◽  
Roland Steiner ◽  
Andriy Romanyuk ◽  
Thomas A. Jung ◽  
...  
Keyword(s):  
Rare Earth ◽  
Surface Chemistry ◽  
Rare Earth Oxide ◽  
Oxide Surfaces ◽  
Ambient Conditions

Use of catalytic reactions to probe Mg-Al mixed oxide surfaces

1994 ◽  
Vol 25 (1-2) ◽  
pp. 87-95 ◽  
Author(s):  
Christopher T. Fishel ◽  
Robert J. Davis
Keyword(s):  
Mixed Oxide ◽  
Catalytic Reactions ◽  
Oxide Surfaces

scholarly journals Interfaces in heterogeneous catalytic reactions: Ambient pressure XPS as a tool to unravel surface chemistry

2017 ◽  
Vol 221 ◽  
pp. 28-43 ◽  
Author(s):  
Robert M. Palomino ◽  
Rebecca Hamlyn ◽  
Zongyuan Liu ◽  
David C. Grinter ◽  
Iradwikanari Waluyo ◽  
...  
Keyword(s):  
Surface Chemistry ◽  
Ambient Pressure ◽  
Catalytic Reactions ◽  
Heterogeneous Catalytic ◽  
Ambient Pressure Xps

scholarly journals Interactive Surface Chemistry of CO2 and NO2 on Metal Oxide Surfaces: Competition for Catalytic Adsorption Sites and Reactivity

2013 ◽  
Vol 117 (15) ◽  
pp. 7713-7720 ◽  
Author(s):  
Evgeny I. Vovk ◽  
Abdurrahman Turksoy ◽  
Valerii I. Bukhtiyarov ◽  
Emrah Ozensoy
Keyword(s):  
Metal Oxide ◽  
Surface Chemistry ◽  
Oxide Surfaces ◽  
Metal Oxide Surfaces ◽  
Adsorption Sites ◽  
Interactive Surface
Sign in / Sign up

Export Citation Format

Share Document