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Time-Dependent Density-Functional Tight-Binding

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1 results in Keywords: Time-Dependent Density-Functional Tight-Binding

Organic Chemistry

Two excited-state datasets for quantum chemical UV-vis spectra of organic molecules

Massimiliano Lupo Pasini, Kshitij Mehta, Pilsun Yoo, Stephan Irle

Version 3 posted 25 July 2023

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