Multiconfiguration pair-density functional theory

Engineering & Materials Science

• Density functional theory 100%
• Wave functions 46%
• Excitation energy 28%
• Calcium oxide 19%
• Potential energy 18%
• Costs 6%

Chemical Compounds

• Energy 31%
• Wave Function 31%
• Electron Spin 22%
• Density Matrix 18%
• Density Functional Theory 16%
• Electronic Excitation 16%
• Perturbation Theory 15%
• Bond Energy 15%
• Pyrazine 14%
• Potential Energy 13%
• Application 4%

Physics & Astronomy

• density functional theory 51%
• self consistent fields 24%
• functionals 17%
• energy 9%
• gradients 9%
• wave functions 7%
• electronics 7%
• pyrazines 6%
• translating 6%
• approximation 5%
• counting 4%
• potential energy 4%
• perturbation theory 4%
• theorems 4%
• costs 3%
• scaling 3%
• kinetics 2%
• symmetry 2%
• curves 2%
• excitation 2%