Compressed-State Multistate Pair-Density Functional Theory

Keyphrases

• Pair Density Functional Theory 100%
• Compressed States 100%
• Multi-configuration 83%
• Intermediate State 83%
• Variational 66%
• Model Space 50%
• Hamiltonian Matrix 33%
• Effective Hamiltonian 33%
• Excited States 16%
• Functional Assessment 16%
• Density Functional 16%
• Computationally Expensive 16%
• Second-order Perturbation Theory 16%
• Electron Density 16%
• Potential Energy Surface 16%
• Conical Intersection 16%
• CASPT2 16%
• Off-diagonal Elements 16%
• Diagonal Element 16%
• Wavefunction Theory 16%
• Diagonalization 16%
• Coulomb Energy 16%
• Space State 16%
• Multireference Methods 16%

Chemistry

• Density Functional Theory 100%
• Excited State 16%
• k·p perturbation theory 16%
• Potential Energy Surface 16%
• Wave Function Theory 16%
• Multireference Method 16%
• Electron Density 16%
• Perturbation Theory 16%