The Impact of Hole Transport Layer Doping on the Efficiency of Organic Solar Cells Studied by OghmaNano Simulation
Teodora Pavličević a, Jovana Gojanović a, Nataša Ćirović a
a School of Electrical Engineering University of Belgrade, Bulevar kralja Aleksandra, 73, Beograd, Serbia
Proceedings of International Conference on Hybrid and Organic Photovoltaics (HOPV25)
Roma, Italy, 2025 May 12th - 14th
Organizers: Filippo De Angelis, Francesca Brunetti and Claudia Barolo
Poster, Jovana Gojanović, 258
Publication date: 17th February 2025

Organic solar cells (OSCs) continue to attract attention because of their simple fabrication, flexibility, large-scale production, wide material sources and low cost. In recent years, there has been significant progress toward developing OSCs that are highly efficient, flexible, lightweight, and stable under environmental conditions. Transport layers (TLs) play a key role in the operation of organic solar cells and their optimization is essential for maximizing their performance. The major role of TLs is to provide the efficient transport of majority carriers from the active layer to the corresponding electrode. For this reason, the mobility of majority carriers in TLs should be as high as possible. Increasing the mobility of majority carriers in TLs is most often achieved by doping [1].

In this presentation the impact of TLs doping on power conversion efficiency (PCE) of OSCs is analyzed. The reported analysis is conducted by OghmaNano software. As a first step the experimental current density-voltage (J-V) characteristics of ITO/PEDOT:PSS/P3HT:PCBM/Al solar cell, taken from literature [2] is reproduced by OghmaNano numerical simulator. The obtained set of simulation parameters are used in the further analysis. We limit ourselves to the analysis of the role of hole transport layer (HTL) doping, the PEDOT:PSS in this case, because in regular OSC configuration electron transport layer (ETL) is too thin to exhibit transport properties. The acceptor concentration in HTL Na is varied in the range 1015-1023cm-3, which is somewhat wider than the values often used in experiments. Usually, in experiments Na is given in weight fraction which changes from 10-5 to 10-1 that can be converted into 1017-1021cm-3. The PCE slightly increases till Na reaches approximately 1017cm-3 which is the value comparable with effective densities of states (Nc, Nv) in the HTL and the active layer (AL). After that PCE abruptly decreases for Na between 1017 and 1018cm-3, which is followed by slight decrease with further increase of Na. On the other hand, the change of hole mobility in HTL μpHTL in the range 10-5- 1cm2/Vs leads to PCE enhancement until μpHTL=10-2cm2/Vs (the value comparable with the hole mobility in the AL), after which the PCE starts to fall. The range of values in which μpHTL is varied is also taken from the literature for PEDOT:PSS. According to previous, we conclude that doping simultaneously exerts two opposite effects on the PCE in OSCs. While an increase in Na lowers the PCE, consequent enhancement of μpHTL generally improves the PCE until the mobility of holes in the AL is reached. For this reason, it is expected that at lower Na when is also low, the influence of μpHTL predominates and PCE increase with doping, while when higher Na and correspondingly higher μpHTL values ​​are applied, doping lead to a decrease in PCE. Therefore, there will be some optimal Na value at which the PCE will have a maximum. This is fully consistent with the experimental results that can be found in [1].

This work was financially supported by the Ministry of Science, Technological Development and Innovation of the Republic of Serbia under contract number: 451-03-137/2025-03/200103.

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