Keyphrases
Catalytic Activity
100%
Metal-organic Frameworks (MOFs)
100%
Layered Metals
100%
Structural Flexibility
100%
Structural Deformation
33%
Oxygen Bonds
33%
Ensemble Approach
33%
Classical Molecular Dynamics
33%
Catalytically Active Sites
33%
Bond Formation
33%
Formation Energy
33%
Quantum Approach
33%
Molecular Dynamics Approach
33%
Site-level
33%
Single Active Site
33%
Structural Heterogeneity
33%
Quantum Molecular Dynamics
33%
Oxidative Dehydrogenation of Propane
33%
Chemistry
Structure
100%
Metal Organic Framework
100%
Statistical Ensemble
50%
Molecular Dynamics
50%
Quantum Mechanics
50%
Oxidative Dehydrogenation
50%
Engineering
Enzymatic Activity
100%
Conductive
100%
Active Site
66%
Bond Formation
33%
Formation Energy
33%
Dehydrogenation
33%
Biochemistry, Genetics and Molecular Biology
Active Site
100%
Dynamics
50%
Oxidative Dehydrogenation
50%
Quantum Mechanics
50%
Material Science
Catalyst Activity
100%
Metal-Organic Framework
100%
Oxidative Dehydrogenation
33%
Chemical Engineering
Metal-Organic Frameworks
100%
Dehydrogenation
50%