Giant values obtained for first hyperpolarizabilities of methyl orange: a DFT investigation
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DOI: 10.1007/s00214-018-2406-x
Abstract: AbstractAdvances in photonics and optoelectronics depend on proposing new materials with well-defined nonlinear optics properties. Based on the foundations of density functional theory, this work presents a systematic investigation of linear and nonlinear optical properties… read more here.
Keywords: iso; first hyperpolarizabilities; giant values; investigation ... See more keywords