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Published in 2017 at "Journal of chemical theory and computation"
DOI: 10.1021/acs.jctc.7b00103
Abstract: The present manuscript reports a thorough quantum investigation on the luminescence properties of three monoplatinum(II) complexes. First, the simulated bond lengths at the ground state are compared to the observed ones, and the simulated electronic…
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Keywords:
phosphorescence spectra;
luminescence properties;
insights simulate;
luminescence ... See more keywords