Accurate density functional calculations on frequency-dependent hyperpolarizabilities of small molecules

S.J.A. van Gisbergen, J.G. Snijders, E.J. Baerends

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Abstract

In this paper we present time-dependent density functional calculations on frequency-dependent first (β) and second (γ) hyperpolarizabilities for the set of small molecules, N
Original languageEnglish
Pages (from-to)10657-10668
Number of pages12
JournalJournal of Chemical Physics
Volume109
DOIs
Publication statusPublished - 1998

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