A team from Jiuhua Laboratory in China has developed a novel "Electronic Structure-Infused Network (ESIN)" model that accurately predicts the photoluminescence quantum yield (PLQY) of organic ...
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Advanced techniques paint a more accurate picture of molecular geometry in metal complexesCurrent theoretical and experimental methods have shown the existence of two isomers for Ir-Ir molecular systems ... DFT is a way to model quantum mechanical systems. These comparisons help ...
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