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Anharmonicity contributions to the vibrational first and second hyperpolarizability of para-disubstituted benzenes

✍ Scribed by Zaleśny, Robert

Book ID
122129321
Publisher
Elsevier Science
Year
2014
Tongue
English
Weight
277 KB
Volume
595-596
Category
Article
ISSN
0009-2614

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Hartree᎐Fock 6-31G level by using coupled Hartree᎐Fock and the double harmonic v Ž . e Ž . oscillator approximations, respectively. Although the ␤ 0 r␤ 0 ratio is slightly larger Ž . than unity and rather constant with respect to the substituent s , it turns out, for the e Ž . monosubstituted compo