Density functional theory study of the decomposition of Mg(OH)₂: A lamellar dehydroxylation model

Engineering & Materials Science

• Density functional theory 98%
• Lattice constants 97%
• Solid solutions 74%
• Compressibility 74%
• Oxides 56%
• Decomposition 47%
• Chemical analysis 42%
• Temperature 26%
• Experiments 23%

Physics & Astronomy

• periclase 100%
• density functional theory 50%
• decomposition 49%
• brucite 36%
• breathing 24%
• compressibility 21%
• lattice parameters 19%
• solid solutions 18%
• trends 16%
• oxides 13%
• temperature 6%

Chemical Compounds

• Dehydroxylation 83%
• Decomposition 42%
• Compressibility 38%
• Lattice Parameter 31%
• Hydroxyl 27%
• Solid Solution 27%
• Density Functional Theory 20%
• Oxide 17%