The sum-over-states technique which is extensively used in calculations of nonlinear optical properties, is presented and discussed. We focus on the electronic contributions to first- and second-order hyperpolarizability. The SOS approach to the calculation of the multiphoton absorption is also discussed. The various approximations to exact sum-over-states formulae are presented. In particular, we describe the so-called few-levels models, which are widely used in qualitative analysis of nonlinear electrical properties.
CITATION STYLE
Bartkowiak, W., & Zaleśny, R. (2006). SOS Methods in Calculations of Electronic NLO Properties. In Challenges and Advances in Computational Chemistry and Physics (Vol. 1, pp. 129–150). Springer. https://doi.org/10.1007/1-4020-4850-5_4
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