[Ru(4,4'-COOH-2,2'-bpy) 2 ((NCS) 2) 分子染料的吸收光谱和溶解色谱根据时间依赖密度功能理论

Simona Fantacci1, Filippo De Angelis, Annabella Selloni

  • 1Istituto CNR di Scienze e Tecnologie Molecolari (ISTM) c/o Dipartimento di Chimica, Università degli studi di Perugia, via Elce di Sotto, 8, I-60123 Perugia, Italy. simona@thch.unipg.it

概括

这项研究详细介绍了太阳能电池中使用的复合物的电子结构和光学特性. 溶剂效应对于准确预测其光吸收光谱至关重要,与实验数据相匹配.

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UV–Vis Spectroscopy of Conjugated Systems01:32

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