Tuning the intermolecular interaction of A_(2)-A_(1)-D-A_(1)-A_(2) type non-fullerene acceptors by substituent engineering for organic solar cells with ultrahigh V_(OC) of ~1.2 V

For non-fullerene acceptors(NFAs)with linear A_(2)-A_(1)-D-A_(1)-A_(2) backbone,there are three kinds of possible intermolecular interaction,A_(1)-A_(1),A_(1)-A_(2) and A_(2)-A_(2) stacking.Hence,it is a huge challenge to control this interaction and investigate the effect of intermolecular stacking model on the photovoltaic performance.Here,we adopt a feasible strategy,by utilizing different substituent groups on terminal A2 unit of dicyanomethylene rhodanine(RCN),to modulate this stacking model.According to theoretical calculation results,the molecule BTA3 with ethyl substituent packs via heterogeneous interaction between A_(2) and A_(1) unit in neighboring molecules.Surprisingly,the benzyl group can effectively transform the aggregation of BTA5 into homogeneous packing of A_(2)-A_(2) model,which might be driven by the strong interaction between benzyl and A1(benzotriazole)unit.However,different with benzyl,phenyl end group impedes the intermolecular interaction of BTA4 due to the large steric hindrance.When using a BTA-based D-π-A polymer J52-F as donor according to“Same-A-Strategy”,BTA3-5 could achieve ultrahigh open-circuit voltage(VOC)of 1.17–1.21 V.Finally,BTA5 with benzyl groups realized an improved power conversion efficiency(PCE)of 11.27%,obviously higher than that of BTA3(PCE=9.04%)and BTA4(PCE=5.61%).It is also worth noting that the same trend can be found when using other four classic p-type polymers of P3HT,PTB7,PTB7-Th and PBDB-T.This work not only investigates the intermolecular interaction of A_(2)-A_(1)-D-A_(1)-A_(2) type NFAs for the first time,but also provides a straightforward and universal method to change the interaction model and improve the photovoltaic performance.

Enhancement of open circuit voltage in organic solar cells by doping a fluorescent red dye

The open circuit voltage （Voc） of small- molecule organic solar cells （OSCs） could be improved by doping suitable fluorescent dyes into the donor layers. In this paper, 4-（dicyanomethylene）-2-t-butyl-6-（1,1,7,7- tetramethyljulolidyl-9-enyl）-4H-pyran （DCJTB） was used as a dopant, and the performance of the OSCs with different DCJTB concentration in copper phthalocyanine （CuPc） was studied. The results showed that the Voc of the OSC with 50% of DCJTB in CuPc increased by 15%, compared with that of the standard CuPc/fullerene （C60） device. The enhancement of the Voc was attributed to the lower highest occupied molecular orbital （HOMO） level in the DCJTB than that in the CuPc. Also, the light absorption intensity is enhanced between 400 and 550nm, where CuPc and C6o have low absorbance, leading to a broad absorption spectrum.