Abstract
Abstract Third‐order hyperpolarizabilities (γ) of silicon compounds are calculated by the ab initio coupled-perturbed Hartree‐Fock (CPHF) method. The basis set dependencies of the γ‐values are first examined. The γ‐values calculated for Si compounds by CPHF (6–31G+PD) are compared with those of corresponding carbon compounds.
Talk to us
Join us for a 30 min session where you can share your feedback and ask us any queries you have
More From: Molecular Crystals and Liquid Crystals Science and Technology. Section A. Molecular Crystals and Liquid Crystals
Disclaimer: All third-party content on this website/platform is and will remain the property of their respective owners and is provided on "as is" basis without any warranties, express or implied. Use of third-party content does not indicate any affiliation, sponsorship with or endorsement by them. Any references to third-party content is to identify the corresponding services and shall be considered fair use under The CopyrightLaw.