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Spectrum of a Hybrid C73H90 Molecule Containing the Stone−Wallace Defect

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Abstract

The spectral characteristics of hybtid cluster C73H90 were calculated using the time-dependent Density Functional Theory method. The calculated spectrum demonstrates two maxima: at 5.7 and 3.8 eV, which are close to those in interstellar medium and laboretory experiments.

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ACKNOWLEDGMENTS

The authors thank E.Yu. Tupikin (St. Petersburg State University) for useful discussions and consultations on the Gaussian package and its application.

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  1. Ioffe Institute, St. Petersburg, Russia

    M. S. Chekulaev & S. G. Yastrebov

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  1. M. S. Chekulaev
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  2. S. G. Yastrebov
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Correspondence to M. S. Chekulaev.

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Chekulaev, M.S., Yastrebov, S.G. Spectrum of a Hybrid C73H90 Molecule Containing the Stone−Wallace Defect. Tech. Phys. Lett. 49, 232–234 (2023). https://doi.org/10.1134/S106378502390011X

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