Title of article :
Theoretical investigation of the chemical bonds in metal chelates as emitting material for OLED
Author/Authors :
Zhang، نويسنده , , Jingping and Wang، نويسنده , , Rongshun، نويسنده ,
Issue Information :
دوماهنامه با شماره پیاپی سال 2005
Abstract :
Geometries of ground (S0) states of mer-tris(8-hydroxyquinolinato)metal (Mq3, M = Al3+, Ga3+, In3+, Tl3+) are optimized by B3LYP/6-31G(d) methods. In order to investigate the distribution for unequal individual ligands in mer-Mq3 as key materials for OLED
Keywords :
Bonding analysis , OLED , Energy partitioning , Mq3
Journal title :
Synthetic Metals
Journal title :
Synthetic Metals
