Gibbs energy-based treatment of metallofullerenes: Ca@C₇₂, Ca@C₇₄, Ca@C₈₂, and La@C₈₂

Keyphrases

• Energy-based 100%
• Metallofullerene 100%
• Gibbs Free Energy 100%
• Density Functional Calculations 50%
• Relative Concentration 50%
• High Temperature 50%
• Quantum Chemistry 50%
• Statistical Mechanics 50%
• Endohedral Fullerenes 50%

Chemistry

• Gibbs Free Energy 100%
• Density Functional Theory 50%
• Enthalpy 50%
• Statistical Mechanics 50%
• Fullerene 50%
• Quantum Chemistry 50%

Chemical Engineering

• Gibbs Free Energy 100%
• Enthalpy 50%
• Fullerene 50%