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- W2079198510 abstract "The polarizability and first hyperpolarizability value of the F–H⋯NH3 hydrogen-bonded complex has been calculated using the ab initio method with different basis sets. In addition, the first hyperpolarizability values of the hydrogen-bonded complexes formed by nitrosubstituted phenols with trimethylamine have been calculated using PM3 and ab initio (STO-3G) methods. It has been shown that enhancement of the first hyperpolarizability (Δβ) of the complex arises from the hydrogen bond interaction between the phenol derivative and trimethylamine." @default.
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- W2079198510 date "2009-06-01" @default.
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- W2079198510 title "Hyperpolarizabilities of some model hydrogen-bonded complexes: PM3 and ab initio studies" @default.
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- W2079198510 doi "https://doi.org/10.1016/j.molstruc.2009.03.024" @default.
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