Performance of the OPBE exchange-correlation functional

Chemistry

• Density Functional Theory 100%
• Purity 50%
• Metallocene 50%
• Enthalpy of Atomization 50%
• Spin State 50%
• Iron Complex 50%
• Zero-Point Vibrational Energy 50%

Keyphrases

• Zero-point Vibrational Energy 50%
• Metallocenes 50%
• Geometry Optimization 50%