Keyphrases
Solvent Effect
100%
Dimethylamino
100%
Benzonitrile
100%
Molecular Dynamics Simulation
100%
Acetonitrile
100%
Intramolecular Charge Transfer
100%
Solvation
60%
Charge Transfer States
40%
Cyclopentane
40%
Electronic Energy
40%
Dual Fluorescence
40%
Energy Levels
20%
Donor Groups
20%
High-level Ab Initio Calculations
20%
Charge Transfer
20%
State Dependence
20%
Energy Gap
20%
Solvation Dynamics
20%
Energy Minimum
20%
Solvation Effect
20%
Potential Energy Profile
20%
Stokes Shift
20%
Equilibrium Molecular Dynamics Simulation
20%
Vertical Excitation Energy
20%
Pair Distribution Function
20%
Gap Distribution
20%
Minimum Energy Path
20%
Solvent Response
20%
Locally Excited State
20%
Twisted Intramolecular Charge Transfer
20%
Ground State Energy
20%
Non-equilibrium Simulations
20%
Charge Transfer Mechanism
20%
Twisted Geometry
20%
Atomic Charges
20%
Singlet State
20%
Acceptor Group
20%
Microscopic Mechanism
20%
Polar Solvents
20%
Excited State Energies
20%
Chemistry
Solvent Effect
100%
Benzonitrile
100%
Solvation
100%
Molecular Dynamics
100%
Acetonitrile
100%
Excited State
40%
Charge Transfer State
40%
Cyclopentane
40%
electronics
40%
Donor
20%
Ground State
20%
Ab Initio Calculation
20%
Nonequilibrium
20%
Band Gap
20%
Polar Solvent
20%
Pair Distribution Function
20%
Singlet State
20%
Potential Energy
20%