First-Principles Study on Ligand Binding and Positional Disorder in Pentlandite

Physics & Astronomy

• ligands 75%
• disorders 57%
• hydroxides 36%
• anions 20%
• flotation 14%
• water 12%
• sulfides 11%
• minerals 10%
• electric contacts 9%
• nickel 8%
• density functional theory 8%
• iron 7%
• boundary conditions 7%
• expansion 6%
• cells 5%
• approximation 5%
• metals 5%
• crystals 5%
• energy 3%

Engineering & Materials Science

• Ligands 100%
• Negative ions 29%
• Flotation agents 21%
• Sulfide minerals 19%
• Density functional theory 16%
• Monolayers 14%
• Water 11%
• Crystals 10%
• Nickel 9%
• Iron 9%
• Boundary conditions 8%
• Metals 6%

Chemical Compounds

• Disorder 64%
• Hydroxide 26%
• Surface 23%
• Flotation Agent 19%
• Ethyl 15%
• Sulfide Mineral 15%
• Anion 12%
• Work Function 12%
• Ligand 9%
• Monolayer 8%
• Molecular Cluster 6%
• Density Functional Theory 6%
• Energy 5%
• Metal 4%