Kinetic Monte Carlo simulations of the water gas shift reaction on Cu(1 1 1) from density functional theory based calculations
Authors:
- Hèctor PratsHPHèctor Prats
- Leny ÁlvarezLÁLeny Álvarez
- Francesc IllasFIFrancesc Illas
- Ramón SayósRSRamón Sayós
- 1 January 2016
- journal article
- research article
- Published by Elsevier in Journal of Catalysis
- Vol. 333, 217-226
Abstract
No abstract availableKeywords
Funding Information
- Spanish MINECO (CTQ2012-30751, CTQ2014-53987-R)
- Generalitat de Catalunya (2014SGR97, 2014SGR1582, XRQTC)
- Secretaría de Ciencia y Tecnología e Innovación del Distrito Federal de la Ciudad de México
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