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Electronic Circular Dichroism of Fullerenols

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We present extensive time-dependent density functional theory calculations dedicated to analyzing the optical properties of model low-hydroxylated C60(OH)12 fullerenols. In all our considered isome... Click to show full abstract

We present extensive time-dependent density functional theory calculations dedicated to analyzing the optical properties of model low-hydroxylated C60(OH)12 fullerenols. In all our considered isome...

Keywords: dichroism fullerenols; circular dichroism; chemistry; electronic circular

Journal Title: Journal of Physical Chemistry C
Year Published: 2020

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