利用线性稠合的吡嗪单元调控电子结构用于高压稳定的锌-有机电池正极
赵敏健a,#, 张立斌a,#, 王金涛a, 丁昆a,*(
)(
), 刘海梅a,*()(), 王永刚b,*()()
)(), 刘海梅a,*()(), 王永刚b,*()()
Modulating Electronic Structure with Linearly Fused Pyrazine Units for High-Voltage and Stable Zinc-Organic Batteries Cathode
Min-Jian Zhaoa,#, Li-Bin Zhanga,#, Jin-Tao Wanga, Kun Dinga,*()(), Hai-Mei Liua,*()(), Yong-Gang Wangb,*()()
)(), Hai-Mei Liua,*()(), Yong-Gang Wangb,*()()
.
Figure 1.. Design strategy of high-voltage n-type cathode material. (a) Schematic illustration of molecular engineering on electrochemical performance of organic cathode. (b) LUMO-HOMO energy levels of DPP and DPQP. (c)ESP and (d)Fukui function plots of DPP and DPQP. (e) The IRI isosurface map of DPQP molecules. (f) ELF color-filled mappings of DPP and DPQP.
