A New Mixing of Nonlocal Exchange and Nonlocal Correlation with Multiconfiguration Pair-Density Functional Theory

Chemical Compounds

• CASSCF Calculation 90%
• Energy 31%
• Electron Correlation Energy 30%
• Electronic Excitation 26%
• Bond Energy 25%

Engineering & Materials Science

• Density functional theory 100%
• Excitation energy 18%
• Correlation methods 13%
• Set theory 7%

Physics & Astronomy

• density functional theory 51%
• self consistent fields 33%
• energy 16%
• scaling 7%
• electronics 5%
• excitation 5%