Validation of Theoretical Methods for the Structure and Energy of Aluminum Clusters

Keyphrases

• Theoretical Method 100%
• Aluminum Clusters 100%
• Parameterized Model 66%
• Atomization Energy 66%
• Accurate Method 66%
• PBE0 66%
• Semi-empirical Methods 66%
• Density Functional Theory 33%
• Total Energy 33%
• Hybrid Density Functional Theory 33%
• Energy Method 33%
• Tight-binding 33%
• Al13 33%
• Energetic Model 33%
• Multilevel Methods 33%
• Alloy Clusters 33%
• Overlapping Model 33%
• Austin Model 1 33%

Chemistry

• Aluminum 100%
• Enthalpy of Atomization 66%
• Symmetric Orthogonalized Intermediate Neglect of Differential Overlap 66%
• Density Functional Theory 33%
• Energetics 33%
• AM1 Calculation 33%

Chemical Engineering

• Atomizer Nozzle 100%