Multiconfiguration Density-Coherence Functional Theory

Keyphrases

• Multi-configuration 100%
• Functional Theory 100%
• Density Functional 50%
• Pair Density Functional Theory 25%
• Density Functional Theory 25%
• Second-order Perturbation Theory 25%
• Two-parameter 25%
• Heteronuclear 25%
• Bond Dissociation Energy 25%
• CASPT2 25%
• MPW1PW91 25%
• Homonuclear Diatomic Molecule 25%
• Comparable Accuracy 25%
• Dissociation Curve 25%
• Coordinate Representation 25%
• Multiconfigurational Wavefunction 25%
• One-particle Density Matrix 25%
• Complete Active Space 25%

Chemistry

• Density Functional Theory 100%
• k·p perturbation theory 50%
• Dissociation Energy 50%
• Density Matrix 50%
• Particle Density 50%
• Perturbation Theory 50%
• Wave Function 50%