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A Coverage Self-Consistent Microkinetic Model for Vapor-Phase Formic Acid Decomposition over Pd/C Catalysts
Saurabh Bhandari
, Srinivas Rangarajan
, Sha Li
, Jessica Scaranto
, Suyash Singh
,
Christos T. Maravelias
, James A. Dumesic
, Manos Mavrikakis
Research output
:
Contribution to journal
›
Article
›
peer-review
14
Scopus citations
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Dive into the research topics of 'A Coverage Self-Consistent Microkinetic Model for Vapor-Phase Formic Acid Decomposition over Pd/C Catalysts'. Together they form a unique fingerprint.
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Keyphrases
Density Functional Theory
100%
Formic Acid Decomposition
100%
Vapor Phase
100%
PDCs
100%
Microkinetic Model
100%
Active Sites
80%
Pd(111)
80%
Pd(100)
60%
Formic Acid
40%
Dehydration
40%
CO Coverage
40%
Reaction Conditions
40%
Carboxyl
20%
Reaction Mechanism
20%
Clean Surface
20%
Kinetic Experiments
20%
Mean Field
20%
High Coverage
20%
Reaction Kinetics
20%
Experimental Dataset
20%
Parametrized
20%
Decomposition Pathway
20%
Dehydrogenation
20%
Rate Parameters
20%
Adsorbed CO
20%
MPW1PW91
20%
(100) Facets
20%
Catalytic Active Sites
20%
Iterative Approach
20%
Parameter Adjustment
20%
Chemical Engineering
Formic Acid
100%
Dehydrogenation
50%
Engineering
Adjustment Parameter
20%