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Title: Quantum chemical studies of light harvesting
Author: Curutchet Barat, Carles E.
Mennucci, Benedetta
Keywords: Química quàntica
Química física
Quantum chemistry
Physical and theoretical chemistry
Issue Date: 25-Jan-2017
Publisher: American Chemical Society
Abstract: The design of optimal light-harvesting (supra)molecular systems and materials is one of the most challenging frontiers of science. Theoretical methods and computational models play a fundamental role in this difficult task, as they allow the establishment of structural blueprints inspired by natural photosynthetic organisms that can be applied to the design of novel artificial light-harvesting devices. Among theoretical strategies, the application of quantum chemical tools represents an important reality that has already reached an evident degree of maturity, although it still has to show its real potentials. This Review presents an overview of the state of the art of this strategy, showing the actual fields of applicability but also indicating its current limitations, which need to be solved in future developments.
Note: Versió postprint del document publicat a:
It is part of: Chemical Reviews, 2017, vol. 117, num. 2, p. 294-343
Related resource:
ISSN: 0009-2665
Appears in Collections:Articles publicats en revistes (Farmàcia, Tecnologia Farmacèutica i Fisicoquímica)

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