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Heavy-atom effect on second hyperpolarizabilities of thiophene homologues investigated by a femtosecond optical-Kerr-effect experiment and ab initio molecular orbital calculation

✍ Scribed by Kamada, Kenji; Ueda, Minoru; Sakaguchi, Toru; Ohta, Koji; Fukumi, Toshio

Book ID
115395448
Publisher
Optical Society of America
Year
1998
Tongue
English
Weight
261 KB
Volume
15
Category
Article
ISSN
0740-3224

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Effect of heavy atom on the second hyper
Effect of heavy atom on the second hyperpolarizability of tetrahydrofuran homologs investigated by ab initio molecular orbital method
✍ Kenji Kamada; Minoru Ueda; Hidemi Nagao; Keiko Tawa; Takushi Sugino; Yo Shimizu; 📂 Article 📅 1998 🏛 John Wiley and Sons 🌐 English ⚖ 264 KB 👁 1 views

Static second hyperpolarizabilities were calculated for molecules including tetrahydrofuran homologs by ab initio molecular orbital methods at the Hartree᎐Fock and various correlation levels. Substitution of the heteroatom with a heavier atom is found to be effective for increase of the second hyper