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Modeling Excited States in TiO 2 Nanoparticles: On the Accuracy of a TD-DFT Based Description
Berardo, Enrico, Hu, Han-Shi, Shevlin, Stephen A., Woodley, Scott M., Kowalski, Karol, Zwijnenburg, Martijn A.Volume:
10
Language:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/ct4010273
Date:
March, 2014
File:
PDF, 2.86 MB
english, 2014