单层
量子点
材料科学
偶极子
Crystal(编程语言)
配体(生物化学)
半导体
密度泛函理论
化学物理
结晶学
纳米技术
光电子学
计算化学
化学
有机化学
生物化学
受体
计算机科学
程序设计语言
作者
Ammar J. Al-Alwani,O. Shinkarenko,А. С. Чумаков,M. V. Pozharov,N N Begletsova,А. С. Колесникова,V. P. Sevostyanova,E. G. Glukhovskoy
标识
DOI:10.1080/02670836.2019.1612141
摘要
In order to understand the effect of capping ligand on optical and electrical properties of semiconductor quantum dots (QDs), we have added liquid crystal (8CB) to the CdSe/CdS/ZnS QDs monolayer formed via the Langmuir Blodgett technique And studied emission spectra and conducting properties of resulting QDs. The assembly of QDs monolayer modified by liquid crystal (8CB) can be tuned by varying the temperature. The mechanism of the influence of capping ligands on the gap energy, dipole moment and charge distribution within (CdSe) 13 cluster was studied via quantum chemical calculations, i.e. we have used density functional theory to systematically investigate the equilibrium configuration of QDs passivated by oleic acid and liquid crystal ligands. GRAPHICAL ABSTRACT
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