Articles with "proxy state" as a keyword



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Using a proxy state to improve the accuracy of truncated hyperpolarizability calculations.

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Published in 2019 at "Optics letters"

DOI: 10.1364/ol.44.000005

Abstract: We present a simple algorithm for defining a single proxy state that accounts for state truncation in the sum-over-states calculations of the dispersion of the molecular hyperpolarizabilities. The transition strengths between the proxy state and… read more here.

Keywords: proxy state; improve accuracy; state improve; accuracy truncated ... See more keywords