Focusing on the mechanism of interfa-cial exciton dissociation in edge-on stacked ZnPc-F_(8)ZnPc aggregate,we employ the fragment particle-hole densities(FPHD)method to con-struct the Hamiltonian of diabatic states an...Focusing on the mechanism of interfa-cial exciton dissociation in edge-on stacked ZnPc-F_(8)ZnPc aggregate,we employ the fragment particle-hole densities(FPHD)method to con-struct the Hamiltonian of diabatic states and use the non-Markovian stochastic Schrödinger equation(NMSSE)to simulate the photo-in-duced dynamics processes.The re-sults show that aggregation effects have a significant impact on the interfacial exciton dissociation process.After photo-excita-tion,the excitons first preferentially delocalize and perform the charge transfer(CT)states in the pure ZnPc or F_(8)ZnPc aggregates within 100 fs.These‘intramolecular’CT states can easi-ly evolve into interfacial CT states by hopping electrons and holes in the intramolecular CT states across the interface.Compared with these exciton dissociation processes,the direct ex-citon dissociation into interfacial CT state is relatively slow due to the small electronic cou-pling and vibrational coherence between the locally excited state and the interfacial CT state.As the temperature rises and the vibronic coherence weakens,the direct dissociation rates are significantly enhanced.This investigation provides valuable insights for the design and opti-mization of high-performance organic photovoltaic devices.展开更多
A kind of soluble phthalocyanine derivative （ZnPc-epoxy derivative） was synthesized, and the influence of C60 on the photoelectric properties of the derivative was studied. The results of ultraviolet-visible （UV-Vi...A kind of soluble phthalocyanine derivative （ZnPc-epoxy derivative） was synthesized, and the influence of C60 on the photoelectric properties of the derivative was studied. The results of ultraviolet-visible （UV-Vis） spectra show that the absorption of the complex is larger than that of the ZnPc-epoxy derivative at B belt. But compared with the derivative, the absorption of the complex decreased at Q belt. The fluorescence spectra show that C60 takes role as annihilation in ZnPc-epoxy derivative. Photo-current tests show that the ZnPc-epoxy derivative-C60 film exhibits increasing photoconductive property.展开更多
In this paper, a significant enhancement in current efficiency of the green tandem organic light-emitting diodes(TOLEDs) is demonstrated, which is based on a buffer-modified charge generation layer(CGL) of fullerene c...In this paper, a significant enhancement in current efficiency of the green tandem organic light-emitting diodes(TOLEDs) is demonstrated, which is based on a buffer-modified charge generation layer(CGL) of fullerene carbon(C60)/zinc-phthalocyanine(ZnPc). Al and MoO3 were used as the buffer-modified layers on both sides of the bilayer C60/ZnPc, respectively. Experimental results show that the inserted Al and MoO3 layers can effectively increase the electron extraction of the CGL for obtaining the device performance enhancement. Compared with that of the green TOLEDs without buffer-modified layers in CGL(37.3 cd·A-1), the current efficiency of the green TOLEDs is increased to 54.1 cd·A-1. Further study results find that the performance can also be improved by optimizing the thickness of Al in the CGL. The maximum current efficiency and maximum luminance of the green TOLEDs achieve 63.5 cd·A-1 and 17 873 cd·m-2, respectively, when the multilayer structure of the CGL is Al(3 nm)/C60(5 nm)/ZnPc(5 nm)/MoO3(3 nm).展开更多
The formation of coordinated dimeric complexes bridged by axial ligands on surface is observed with the help of a 1,3,5-tris（10-carboxydecyloxy）benzene（TCDB） template through scanning tunneling microscopy（STM）. ...The formation of coordinated dimeric complexes bridged by axial ligands on surface is observed with the help of a 1,3,5-tris（10-carboxydecyloxy）benzene（TCDB） template through scanning tunneling microscopy（STM）. STM images of molecular adlayers of zinc tetraphenylporphyrin（Zn TPP）, zinc phthalocyanine（Zn Pc）, and their mixture are reported. Zn TPP and Zn Pc can spontaneously form highly an ordered structure with a 1：1 molar ratio, which is different from that of individual Zn Pc. The coordinated bimolecular complexes bridged with axial ligands, simply as Zn Pc–DPP–Zn TPP and Zn Pc–DPE–Zn Pc, are presented and the corresponding surface structures are compared. Zn Pc and Zn TPP can be connected by an axial ligand DPP and formed assembled structures out of surface. Two types of arrays with entirely new structure are obtained for the Zn Pc–DPE–Zn Pc complex. These bridged hybrid complexes provide an example of design of self-organized crystals on the basis of coordination through non-covalent interactions.展开更多
基金supported by the National Natural Science Foundation of China(Nos.22033006,22173074,22473091, 92372105).
文摘Focusing on the mechanism of interfa-cial exciton dissociation in edge-on stacked ZnPc-F_(8)ZnPc aggregate,we employ the fragment particle-hole densities(FPHD)method to con-struct the Hamiltonian of diabatic states and use the non-Markovian stochastic Schrödinger equation(NMSSE)to simulate the photo-in-duced dynamics processes.The re-sults show that aggregation effects have a significant impact on the interfacial exciton dissociation process.After photo-excita-tion,the excitons first preferentially delocalize and perform the charge transfer(CT)states in the pure ZnPc or F_(8)ZnPc aggregates within 100 fs.These‘intramolecular’CT states can easi-ly evolve into interfacial CT states by hopping electrons and holes in the intramolecular CT states across the interface.Compared with these exciton dissociation processes,the direct ex-citon dissociation into interfacial CT state is relatively slow due to the small electronic cou-pling and vibrational coherence between the locally excited state and the interfacial CT state.As the temperature rises and the vibronic coherence weakens,the direct dissociation rates are significantly enhanced.This investigation provides valuable insights for the design and opti-mization of high-performance organic photovoltaic devices.
基金The work was supported by the National Natural Science Foundation of China （Grant No. 90206017） the Key Subject of Ministry of Science and Technology of China （Grant No. 2003BA301A21）+1 种基金the Applied Materials （AM） Foundation （Grant No. 0208） the Key Subject Construction Project （Material Science） of Shanghai Educational Committee.
文摘A kind of soluble phthalocyanine derivative （ZnPc-epoxy derivative） was synthesized, and the influence of C60 on the photoelectric properties of the derivative was studied. The results of ultraviolet-visible （UV-Vis） spectra show that the absorption of the complex is larger than that of the ZnPc-epoxy derivative at B belt. But compared with the derivative, the absorption of the complex decreased at Q belt. The fluorescence spectra show that C60 takes role as annihilation in ZnPc-epoxy derivative. Photo-current tests show that the ZnPc-epoxy derivative-C60 film exhibits increasing photoconductive property.
基金supported by the Scientific and Technological Research Foundation of Chongqing Municipal Education Commission(No.KJ1600439)the Basic and Advanced Technology Research Project of Chongqing Municipality(No.cstc2018jcyjAX0462)the Scientific and Technological Research Foundation of Chongqing Municipal Education Commission(No.KJ1500404)
文摘In this paper, a significant enhancement in current efficiency of the green tandem organic light-emitting diodes(TOLEDs) is demonstrated, which is based on a buffer-modified charge generation layer(CGL) of fullerene carbon(C60)/zinc-phthalocyanine(ZnPc). Al and MoO3 were used as the buffer-modified layers on both sides of the bilayer C60/ZnPc, respectively. Experimental results show that the inserted Al and MoO3 layers can effectively increase the electron extraction of the CGL for obtaining the device performance enhancement. Compared with that of the green TOLEDs without buffer-modified layers in CGL(37.3 cd·A-1), the current efficiency of the green TOLEDs is increased to 54.1 cd·A-1. Further study results find that the performance can also be improved by optimizing the thickness of Al in the CGL. The maximum current efficiency and maximum luminance of the green TOLEDs achieve 63.5 cd·A-1 and 17 873 cd·m-2, respectively, when the multilayer structure of the CGL is Al(3 nm)/C60(5 nm)/ZnPc(5 nm)/MoO3(3 nm).
文摘制备了以Zn Pc(OC8H17OPy CH3I)8为阴极缓冲层、P3HT∶PCBM为有源层的有机太阳能电池。对阴极缓冲层Zn Pc(OC8H17OPy CH3I)8薄膜分别进行了溶剂蒸汽退火和过渡舱惰性气体流退火处理,并利用原子力显微镜(AFM)对缓冲层表面形貌进行了表征。结果表明:这两种退火方法都使缓冲层形貌得以改善。电池效率从2.14%提高到3.76%,电流密度从8.12 m A/cm2提高到10.71 m A/cm2,填充因子从0.45提高到0.61。与传统器件相比,退火处理的阴极缓冲层器件的稳定性也得到了改善,器件寿命延长了1.4倍。这种简单阴极界面处理方法为改善聚合物太阳能电池性能提供了有效途径。
基金supported by the National Basic Research Program of China (No. 2013CB934200)National Basic Research Program of China (No. 2012CB933001)+1 种基金The Chinese Academy of Sciences (No. YZ201318)the National Natural Science Foundation of China (Nos. 21472029, 51173031, 91127043, 51203030, 51463002)
文摘The formation of coordinated dimeric complexes bridged by axial ligands on surface is observed with the help of a 1,3,5-tris（10-carboxydecyloxy）benzene（TCDB） template through scanning tunneling microscopy（STM）. STM images of molecular adlayers of zinc tetraphenylporphyrin（Zn TPP）, zinc phthalocyanine（Zn Pc）, and their mixture are reported. Zn TPP and Zn Pc can spontaneously form highly an ordered structure with a 1：1 molar ratio, which is different from that of individual Zn Pc. The coordinated bimolecular complexes bridged with axial ligands, simply as Zn Pc–DPP–Zn TPP and Zn Pc–DPE–Zn Pc, are presented and the corresponding surface structures are compared. Zn Pc and Zn TPP can be connected by an axial ligand DPP and formed assembled structures out of surface. Two types of arrays with entirely new structure are obtained for the Zn Pc–DPE–Zn Pc complex. These bridged hybrid complexes provide an example of design of self-organized crystals on the basis of coordination through non-covalent interactions.
