An ab initio and semiempirical study of the first- and third-order polarizabilities in benzene and thiophene derivatives: Electron correlation effects

Keyphrases

• First-order 100%
• Ab Initio Study 100%
• Third-order Polarizability 100%
• Benzene Derivatives 100%
• Thiophene Derivatives 100%
• Electron Correlation Effects 100%
• Semi-empirical Study 100%
• Nonlinear Optical Properties 33%
• Electron Correlation 33%
• Single Excitation 33%
• Double Excitation 33%
• Molecular Architecture 33%
• Polarizability 33%
• Quinoid Structure 33%
• Configuration Interaction 33%
• Molecular Polarizability 33%
• Correction Vector 33%
• Vector Method 33%
• Interaction Techniques 33%
• Optical Nonlinearity 33%
• Nonlinear Optical Response 33%
• MP2 Theory 33%
• Extended Basis 33%
• Finite Field Approach 33%
• Sensitive Dependence 33%
• Second-order Perturbation 33%

Chemistry

• Electron Correlation 100%
• Polarizability 100%
• Thiophene 100%
• Nonlinear Optical Property 20%
• Quinonoid Zwitterion 20%
• INDO Calculation 20%
• Configuration Interaction 20%
• Møller-Plesset Perturbation Theory 20%

Engineering

• Polarizability 100%
• Nonlinearity 25%
• Combined Method 25%
• Molecular Architecture 25%
• Molecular Polarizabilities 25%