Keyphrases
Quantum Chemistry
100%
Third-order Nonlinear Optical Response
100%
Trans-stilbene
100%
Cis-stilbene
100%
Koopman Theory
66%
CAM-B3LYP
66%
Delocalization Error
66%
Bishop
33%
Experimental Values
33%
Solvent Effect
33%
Cis-isomer
33%
Molecular Switches
33%
Inconsistency
33%
Quantum Chemical Methods
33%
DFT Calculations
33%
Apolar Solvents
33%
Comparison Experiment
33%
Optical Contrast
33%
Frequency Dispersion
33%
Third-order Nonlinear Optics
33%
Second Hyperpolarizability
33%
CCSD(T)
33%
IEFPCM
33%
Stilbenes
33%
Vibrational Contributions
33%
DFT Method
33%
Implicit Solvation Model
33%
Costing Methods
33%
Polynomial Expansion
33%
INIS
investigations
100%
nonlinear problems
100%
chemistry
100%
stilbene
100%
values
60%
cost
40%
errors
40%
comparative evaluations
40%
accuracy
40%
solvents
40%
functionals
40%
cam
40%
reliability
20%
accounting
20%
dispersions
20%
isomers
20%
experimental data
20%
switches
20%
expansion
20%
polynomials
20%
measured values
20%
solvation
20%
Chemistry
Density Functional Theory
100%
Quantum Chemistry
100%
Trans-Stilbene
100%
Cis-Stilbene
100%
DFT-B3LYP Calculation
66%
Solvent Effect
33%
Hyperpolarizability
33%
CCSD
33%
Møller-Plesset Perturbation Theory
33%
Solvation
33%
Cis Isomer
33%
Stilbene
33%
Engineering
Computer Aided Manufacturing
100%
Measured Value
50%
Frequency Dispersion
50%
Experimental Value
50%
Polynomial Expansion
50%
Earth and Planetary Sciences
Quantum Chemistry
100%
Stilbene
100%
Density Functional Theory
60%
Solvation
20%