Benchmark Study on Phosphorescence Energies of Anthraquinone Compounds: Comparison between TDDFT and UDFT

Phosphorescent material is widely used in light-emitting devices and in the monitoring of cell phenomena. Anthraquinone compounds (AQs), as important phosphorescent materials, have potential applications as emitters for highly efficient organic light-emitting diodes (OLEDs). Therefore, the accurate...

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Номзүйн дэлгэрэнгүй

Үндсэн зохиолчид:	Yujie Guo, Lingyu Zhang, Zexing Qu
Формат:	Artigo
Хэл сонгох:	Inglês
Хэвлэсэн:	MDPI AG 2023-04-01
Цуврал:	Molecules
Нөхцлүүд:	phosphorescence energies time-dependent density functional theory (TDDFT) anthraquinone
Онлайн хандалт:	https://www.mdpi.com/1420-3049/28/7/3257
Шошгууд:	Шошго нэмэх Шошго байхгүй, Энэхүү баримтыг шошголох эхний хүн болох!