基于吡嗪空穴传输层的合成及在p-i-n型钙钛矿太阳能电池中的应用  

Synthesis of Pyrazine-based Hole Transport Layer and Its Application in p-i-n Planar Perovskite Solar Cells

作　　者：许桂英 薛荣明 张默瑶 李耀文[1] 李永舫[1,2] Guiying Xu;Rongming Xue;Moyao Zhang;Yaowen Li;Yongfang Li(Laboratory of Advanced Optoelectronic Materials,College of Chemistry,Chemical Engineering and Materials Science,Soochow University,Suzhou 215123,Jiangsu Province,China;Beijing National Laboratory for Molecular Sciences,Institute of Chemistry,Chinese Academy of Sciences,Beijing 100190,China)

机构地区：[1]先进光电材料重点实验室,苏州大学材料与化学化工学部,江苏苏州215123 [2]中国科学院化学研究所,北京分子科学国家研究中心,北京100190

出　　处：《物理化学学报》2021年第4期167-175,共9页Acta Physico-Chimica Sinica

基　　金：国家自然科学基金(51922074,51673138,51820105003);江苏高校优势学科建设工程项目;江苏省研究生科研与实践创新计划项目(KYCPTTPA8_2496)资助。

摘　　要：钙钛矿太阳能电池由于具有高的光电转换效率,简单的溶液加工工艺,较低的成本等优势因而拥有广阔的应用前景。有机小分子空穴传输层材料在钙钛矿太阳能电池中扮演着极其重要的角色。在本工作中,我们设计和合成了基于吡嗪为分子中心核,三苯胺为分枝的X型空穴传输层材料PT-TPA。与Si-OMeTPA对比,吡嗪的引入不仅不会影响其结晶性,并且能够改善其电荷转移特性和分子中心共平面性,从而显著提升了PT-TPA的空穴迁移率。在非掺杂的情况之下,基于PT-TPA空穴传输层的p-i-n型钙钛矿太阳能电池展现出17.52%的光电转换效率,与相同条件下基于Si-OMeTPA空穴传输层的器件相比,效率提高了近15%。Planar p-i-n perovskite solar cells(pero-SCs)with solutionprocessed fabrication,low cost,flexible device fabrication,and negligible hysteresis have attracted significant interest.Hole transport material(HTM)plays a crucial role in improving the performance of p-i-n planar pero-SCs by facilitating hole extraction and then reducing surface recombination.Two types of HTMs have been used in p-i-n pero-SCs.p-Type inorganic semiconductors,such as NiO,CuI,Cu2O,CuSCN,and graphene oxide,have shown good efficiency and stability;however,organic semiconductor-based HTMs(e.g.,poly[bis(4-phenyl)(2,4,6-trimethylphenyl)amine](PTAA),polyarylamine(poly-TPD),poly(N-9-heptadecanyl-2,7-carbazole-alt-5,5-(4,7-di(thien-2-yl)-2,1,3-benzothiadiazole))(PCDTBT),and triphenylamine or thiophene derivative)have outstanding processability for simple onestep solution process at low temperatures;therefore,they should be investigated further.However,their electrical properties are usually inferior than those of inorganic semiconductors,and additives are required to improve their mobility and conductivity,which complicates device processing and results in hysteresis and poor device stability.Therefore,for the organic semiconductor-based HTMs,new hole transport layer(HTL)materials should be developed with easy synthesis process,highly reproducible photovoltaic performance,and better understanding of the structure–property relationship between the HTL materials and the device performance.Herein,an X-type HTM 4,4,4″,4■-(pyrazine-2,3,5,6-tetrayl)tetrakis(N,N-bis(4-methoxyphenyl)aniline)(PT-TPA)containing pyrazine as the molecular core and triphenylamine(TPA)derivative as branches was designed and synthesized.We introduce an electron-deficient para-diazine as the core and electron-donating methoxytriphenylamine as the peripheral unit to enhance the dipole moment of PT-TPA,which could induce an intermolecular charge transfer.Compared with 4,4″,4″,4■-silanetetrayltetrakis(N,N-bis(4-methoxyphenyl)aniline)(Si-OMeTPA),the pyrazine core not only

关 键 词：吡嗪 空穴传输层 有机小分子 p-i-n型钙钛矿太阳能电池 结构与性能关系 

分 类 号：O646[理学—物理化学] O649[理学—化学]