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DOI 10.1039/AN996210113N
Impact Factor 4.616
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Front/Back Matter

DOI: 10.1039/C9CP90022E

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DOI: 10.1039/C9CP90021G

Extending the perturbed matrix method beyond the dipolar approximation: comparison of different levels of theory

Laura Zanetti-Polzi, Sara Del Galdo, Isabella Daidone, Marco D'Abramo, Vincenzo Barone, Massimiliano Aschi, Andrea Amadei

2018-09-07 Paper

DOI: 10.1039/C8CP04190C

Revealing the role of phosphoric acid in all-vanadium redox flow batteries with DFT calculations and in situ analysis

Fabio Jonas Oldenburg, Marta Bon, Daniele Perego, Daniela Polino, Teodoro Laino, Lorenz Gubler

2018-08-31 Paper

DOI: 10.1039/C8CP04517H

Exciton localization in excited-state dynamics of a tetracene trimer: a surface hopping LC-TDDFTB study

Evgenii Titov, Alexander Humeniuk, Roland Mitrić

2018-09-17 Paper

DOI: 10.1039/C8CP05240A

Unravelling the solvent polarity effect on the excited state intramolecular proton transfer mechanism of the 1- and 2-salicylideneanthrylamine. A TD-DFT case study

Wilver A. Muriel, Rodrigo Morales-Cueto, William Rodríguez-Córdoba

2018-12-10 Paper

DOI: 10.1039/C8CP06298F

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