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Title: The quantum mechanics derived atomistic mechanism underlying the acceleration of catalytic CO oxidation on Pt(110) by surface acoustic waves

Abstract

Quantum mechanics simulations unveil the mechanism of surface acoustic waves (SAW) enhancement of CO oxidation on Pt(110) via shock spikes.

Authors:
 [1];  [1];  [1];  [2];  [2];  [2];  [3];  [1]
  1. California Inst. of Technology (CalTech), Pasadena, CA (United States)
  2. CNR-ICCOM and IPCF, Pisa (Italy)
  3. California Inst. of Technology (CalTech), Pasadena, CA (United States); CNR-ICCOM and IPCF, Pisa (Italy)
Publication Date:
Research Org.:
California Inst. of Technology (CalTech), Pasadena, CA (United States)
Sponsoring Org.:
USDOE Advanced Research Projects Agency - Energy (ARPA-E)
OSTI Identifier:
1437589
Grant/Contract Number:  
AR0000552
Resource Type:
Accepted Manuscript
Journal Name:
Journal of Materials Chemistry. A
Additional Journal Information:
Journal Volume: 4; Journal Issue: 31; Journal ID: ISSN 2050-7488
Publisher:
Royal Society of Chemistry
Country of Publication:
United States
Language:
English
Subject:
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY

Citation Formats

An, Qi, Qian, Jin, Nielsen, Robert R., Sementa, Luca, Barcaro, Giovanni, Negreiros, Fabio R., Fortunelli, Alessandro, and Goddard, III, William A. The quantum mechanics derived atomistic mechanism underlying the acceleration of catalytic CO oxidation on Pt(110) by surface acoustic waves. United States: N. p., 2016. Web. doi:10.1039/c6ta03669d.
An, Qi, Qian, Jin, Nielsen, Robert R., Sementa, Luca, Barcaro, Giovanni, Negreiros, Fabio R., Fortunelli, Alessandro, & Goddard, III, William A. The quantum mechanics derived atomistic mechanism underlying the acceleration of catalytic CO oxidation on Pt(110) by surface acoustic waves. United States. doi:10.1039/c6ta03669d.
An, Qi, Qian, Jin, Nielsen, Robert R., Sementa, Luca, Barcaro, Giovanni, Negreiros, Fabio R., Fortunelli, Alessandro, and Goddard, III, William A. Tue . "The quantum mechanics derived atomistic mechanism underlying the acceleration of catalytic CO oxidation on Pt(110) by surface acoustic waves". United States. doi:10.1039/c6ta03669d. https://www.osti.gov/servlets/purl/1437589.
@article{osti_1437589,
title = {The quantum mechanics derived atomistic mechanism underlying the acceleration of catalytic CO oxidation on Pt(110) by surface acoustic waves},
author = {An, Qi and Qian, Jin and Nielsen, Robert R. and Sementa, Luca and Barcaro, Giovanni and Negreiros, Fabio R. and Fortunelli, Alessandro and Goddard, III, William A.},
abstractNote = {Quantum mechanics simulations unveil the mechanism of surface acoustic waves (SAW) enhancement of CO oxidation on Pt(110) via shock spikes.},
doi = {10.1039/c6ta03669d},
journal = {Journal of Materials Chemistry. A},
number = 31,
volume = 4,
place = {United States},
year = {2016},
month = {6}
}

Journal Article:
Free Publicly Available Full Text
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Cited by: 1 work
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