Keyphrases
Excited States
100%
State-based
100%
Diabatic
100%
Multi-state Density Functional Theory
100%
Construction Method
100%
Diabatic States
38%
Adiabatic States
30%
Active Space
15%
Well-defined
7%
Configuration Interaction
7%
Potential Energy Surface
7%
Valence Bond
7%
Quantitative Characterization
7%
Molecular Geometry
7%
Bonding Character
7%
Electronic States
7%
Singlet State
7%
Ground Electronic State
7%
Construction Approach
7%
Excited Electronic States
7%
Energetic Characteristics
7%
Similarity Transformation
7%
Dissociation Threshold
7%
Curve Crossing
7%
Interatomic Separation
7%
Construction State
7%
Construction Strategy
7%
Diabatization
7%
Experimental Observable
7%
Chemistry
Excited State
100%
Ground State
100%
Density Functional Theory
100%
Electronic State
25%
Energetics
25%
Configuration Interaction
25%
Potential Energy Surface
25%
Singlet State
25%
Molecular Geometry
25%
Excited Electronic State
25%