The surface chemistry of NO_x on mackinawite (FeS) surfaces: A DFT-D2 study

Medicine & Life Sciences

• ferrous sulfide 100%
• Nitric Oxide 43%
• Adsorption 41%
• Density Functional Theory 13%
• Nitrogen Dioxide 10%
• Gases 6%

Physics & Astronomy

• chemistry 45%
• nitrogen 39%
• adsorption 29%
• dissociation 25%
• nitrogen dioxide 10%
• configurations 8%
• activation 6%
• density functional theory 5%
• activation energy 5%
• geometry 4%
• molecules 4%
• gases 3%
• interactions 3%
• energy 2%

Chemical Compounds

• Surface Chemistry 48%
• Nitrogen 27%
• Dissociation 21%
• Surface 17%
• Dissociative Adsorption 9%
• Nitrogen Dioxide 9%
• Adsorption 7%
• Energy Barrier 7%
• Reaction Activation Energy 5%
• Density Functional Theory 4%
• Gas 4%
• Energy 3%
• Molecule 2%