Phase diagram and thermodynamic properties of AIPOinf4/inf based on first-principles calculations and the quasiharmonic approximation

Earth & Environmental Sciences

• moganite 100%
• thermodynamic property 67%
• diagram 44%
• calculation 30%
• bulk modulus 24%
• heat capacity 21%
• equation of state 21%
• perturbation 14%
• experiment 14%
• compression 14%
• transform 14%
• temperature 14%
• method 4%

Chemical Compounds

• Phase Diagrams 51%
• Thermodynamic Property 50%
• Bulk Modulus 38%
• Equation of State 32%
• Perturbation Theory 32%
• Pressure 32%
• Heat Capacity 28%
• Density Functional Theory 17%
• Ambient Reaction Temperature 15%

Engineering & Materials Science

• Phase diagrams 72%
• Thermodynamic properties 52%
• Specific heat 29%
• Temperature 22%
• Density functional theory 21%
• Equations of state 16%
• Computational methods 14%
• Elastic moduli 11%
• Experiments 10%
• Hot Temperature 6%