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Density functional theory studies of acid catalysis & electrocatalysis
Michael J. Janik
Chemical Engineering
Materials Research Institute (MRI)
Institute of Energy and the Environment (IEE)
Research output
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Contribution to conference
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Paper
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peer-review
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Dive into the research topics of 'Density functional theory studies of acid catalysis & electrocatalysis'. Together they form a unique fingerprint.
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Keyphrases
Deactivation
100%
Density Functional Theory
100%
Electrocatalysis
100%
Acid Catalysis
100%
Electrocatalyses
100%
Proton Transport
80%
Heteropolyacid
60%
Activation Barrier
60%
Alkylation
40%
Reaction Activation
40%
Reaction Energy Barrier
40%
Isobutane
40%
Materials Research
20%
Hydrocarbons
20%
Catalytic Mechanism
20%
Partial Pressure
20%
Desorption
20%
Order of Magnitude
20%
High Temperature
20%
Reaction Conditions
20%
Regeneration
20%
Hydronium Ion
20%
Molecular Pathways
20%
Reaction Rate Constant
20%
Catalytic Reaction
20%
Proton Conductivity
20%
Direct Methanol Fuel Cell
20%
Proton Conduction
20%
Kinetic Model
20%
Realistic Model
20%
Industrial Application
20%
Catalyst Activity
20%
Role of Water
20%
Reaction Environment
20%
Heterogeneous Catalysis
20%
Doctoral Studies
20%
Solution Phase
20%
Water Adsorption
20%
Atomic Structure
20%
Strong Acid
20%
Postdoctoral Scholars
20%
Equilibrium Constant
20%
Proton Conducting Membrane
20%
Quantum Chemical Methods
20%
Methanol Oxidation
20%
Oxygen Reduction
20%
Ab Initio Methods
20%
Butene
20%
Acid Catalyst
20%
Oxidation-reduction
20%
Solid Acid Catalyst
20%
Effective Material
20%
Water Lead
20%
Time on Stream
20%
Catalyst Selectivity
20%
Electrocatalytic System
20%
Liquid Acid
20%
Reaction Equilibrium Constant
20%
Chemistry
Density Functional Theory
100%
Acid Catalysis
100%
Density Functional Theory Study
100%
Electrocatalysis
100%
Equilibrium Constant
66%
Butene
66%
Acid Catalyst
66%
Isobutane
66%
Polyoxometalate
66%
Desorption
33%
Rate Constant
33%
Reaction Rate Constant
33%
Isomerization
33%
Methanol
33%
Catalytic Reaction
33%
Energetics
33%
Toxic
33%
Chemical Kinetics Characteristics
33%
Partial Pressure
33%
Heterogeneous Catalysis
33%
Chemical Method
33%
Direct Methanol Fuel Cell
33%
Oxygen Reduction Reaction
33%
Calculation Method
33%
Oxidation-Reduction
33%
Material Science
Density
100%
Electrocatalysis
100%
Acid Catalysis
100%
Polyoxometalate
50%
Oxidation Reaction
25%
Desorption
25%
Methanol Fuels
25%
Atomic Structure
25%
Catalyst Activity
25%
Heterogeneous Catalysis
25%
Ab Initio Method
25%
Chemical Processing
25%
Catalyst Selectivity
25%
Chemical Engineering
Methanol
100%
Alkylation
100%
Butene
100%
Desorption
50%
Catalytic Reaction
50%
Time on Stream
50%
Proton Conducting Membrane
50%