Improving CNT-Si solar cells by metal chloride-to-oxide transformation

Transitional metal oxides (TMOs) are important functional materials in silicon-based and thin-film optoelectronics. Here, TMOs are applied in carbon nanotube (CNT)-Si solar cells by spin-coating solutions of metal chlorides that undergo favorable transformation in ambient conditions. An unconventional change in solar cell behavior is observed after coating two particular chlorides (MoCl₅ and WCl₆, respectively), characterized by an initial severe degradation followed by gradual recovery and then well surpassing the original performance. Detailed analysis reveals that the formation of corresponding oxides (MoO₃ and WO₃) enables two primary functions on both CNTs (p-type doping) and Si (inducing inversion layer), leading to significant improvement in open-circuit voltage and fill factor, with power conversion efficiencies up to 13.0% (MoO₃) and 13.4% (WO₃). Further combining with other chlorides to increase the short-circuit current, ultimate cells efficiencies achieve >16% with over 90% retention after 24 h, which are among the highest stable efficiencies reported for CNT-Si solar cells. The transformation of functional layers as demonstrated here has profound influence on the device characteristics, and represents a potential strategy in low-cost manufacturing of next-generation high efficiency photovoltaics.