CO₂ Adsorption on Ti₃O₆^-: A Novel Carbonate Binding Motif

Keyphrases

• Carbonate 100%
• Binding Motif 100%
• CO2 Adsorption 100%
• Density Functional Theory 33%
• Doublet 33%
• Density Functional Calculations 33%
• Tridentate 33%
• Bidentate 33%
• Oxygen Vacancy 33%
• Negatively Charged 33%
• IR Spectra 33%
• Dianion 33%
• Stretching Mode 33%
• CO2 Molecule 33%
• IR Signature 33%
• Titanium Surface 33%
• Spectral Window 33%
• Infrared Photodissociation 33%
• Infrared Photodissociation Spectroscopy 33%
• Artificial Force Induced Reaction 33%
• Coupled-cluster Computations 33%
• O-atom 33%
• CO2 Binding 33%
• Unpaired Electron 33%

Chemistry

• Carbon Dioxide 100%
• Photodissociation 40%
• Density Functional Theory 40%
• Titanium Dioxide 20%
• Spectroscopy 20%
• Oxygen Vacancy 20%
• IR Spectrum 20%
• Coupled Cluster 20%