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Fletta eftir höfundi "Levi, Gianluca"
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(Royal Society of Chemistry (RSC), 2020)Copper(I) bis-phenanthroline complexes represent Earth-abundant alternatives to ruthenium-based sensitizers for solar energy conversion and photocatalysis. Improved understanding of the solvent- mediated excited-state structural dynamics can help ... -
(Royal Society of Chemistry (RSC), 2020-06)A direct optimization method for obtaining excited electronic states using density functionals is presented. It involves selective convergence on saddle points on the energy surface representing the variation of the energy as a function of the electronic ...
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