An ab Initio and Semiempirical Study of the First- and Third-Order Polarizabilities in Benzene and Thiophene Derivatives: Electron Correlation Effects
- 1 April 1997
- journal article
- research article
- Published by American Chemical Society (ACS) in The Journal of Physical Chemistry A
- Vol. 101 (16) , 3025-3031
- https://doi.org/10.1021/jp9630129
Abstract
No abstract availableKeywords
This publication has 40 references indexed in Scilit:
- Ab initio finite oligomer method for nonlinear optical properties of conjugated polymers. Hartree–Fock static longitudinal hyperpolarizability of polyacetyleneThe Journal of Chemical Physics, 1995
- A coupled-cluster based effective Hamiltonian method for dynamic electric polarizabilitiesThe Journal of Chemical Physics, 1993
- Static and dynamic third-harmonic generation in long polyacetylene and polyparaphenylene vinylene chainsPhysical Review B, 1991
- A b i n i t i o calculations of polarizability and second hyperpolarizability in benzene including electron correlation treated by Mo/ller–Plesset theoryThe Journal of Chemical Physics, 1989
- Ab initio calculations of polarizabilities and second hyperpolarizabilities in organic molecules with extended .pi.-electron conjugationThe Journal of Physical Chemistry, 1989
- Third-order nonlinear optical properties of a soluble conjugated polythiophene derivativeApplied Physics Letters, 1989
- Electronic structure and nonlinear optical properties of aromatic polymers and their derivativesSynthetic Metals, 1989
- A systematic study of polarizability and microscopic third-order optical nonlinearity in thiophene oligomersThe Journal of Chemical Physics, 1988
- Forces in MoleculesPhysical Review B, 1939
- Note on an Approximation Treatment for Many-Electron SystemsPhysical Review B, 1934