Gonzalo Canduela Rodriguez
No current affiliation with UGent
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- PhD Thesis
- open access
First principles based design of bimetallic catalysts for benzene hydrogenation
(2015) -
Ab initio based coverage dependent kinetics for benzene hydrogenation
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Coverage dependent kinetics of benzene hydrogenation on Pt and Pd catalysts
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Thermodynamic study of benzene and hydrogen coadsorption on Pd(111)
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Periodic DFT study of benzene adsorption on Pd(100) and Pd(110) at medium and saturation coverage
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Multi-scale modeling of benzene hydrogenation on Pd(111)
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Reaction path and coverage effects analysis of benzene hydrogenation on Pd(111)
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Micro-kinetic modeling of benzene hydrogenation on Pd(111) as a function of hydrogen coverage
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- Conference Paper
- C3
- open access
Ab initio based micro-kinetic modeling of benzene hydrogenation on Pd(111) as a function of hydrogen coverage
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Multi-scale modeling of benzene hydrogenation on Pd-based bimetallic catalysts