Magnetic-biased chiral molecules enabling highly oriented photovoltaic perovskites.

The interaction between sites A, B and X with passivation molecules is restricted when the conventional passivation strategy is applied in perovskite (ABX3) photovoltaics. Fortunately, the revolving A-site presents an opportunity to strengthen this interaction by utilizing an external field. Herein, we propose a novel approach to achieving an ordered magnetic dipole moment, which is regulated by a magnetic field via the coupling effect between the chiral passivation molecule and the A-site (formamidine ion) in perovskites. This strategy can increase the molecular interaction energy by approximately four times and ensure a well-ordered molecular arrangement. The quality of the deposited perovskite film is significantly optimized with inhibited nonradiative recombination. It manages to reduce the open-circuit voltage loss of photovoltaic devices to 360 mV and increase the power conversion efficiency to 25.22%. This finding provides a new insight into the exploration of A-sites in perovskites and offers a novel route to improving the device performance of perovskite photovoltaics.

Sublimed C60 for efficient and repeatable perovskite-based solar cells.

Thermally evaporated C60 is a near-ubiquitous electron transport layer in state-of-the-art p-i-n perovskite-based solar cells. As perovskite photovoltaic technologies are moving toward industrialization, batch-to-batch reproducibility of device performances becomes crucial. Here, we show that commercial as-received (99.75% pure) C60 source materials may coalesce during repeated thermal evaporation processes, jeopardizing such reproducibility. We find that the coalescence is due to oxygen present in the initial source powder and leads to the formation of deep states within the perovskite bandgap, resulting in a systematic decrease in solar cell performance. However, further purification (through sublimation) of the C60 to 99.95% before evaporation is found to hinder coalescence, with the associated solar cell performances being fully reproducible after repeated processing. We verify the universality of this behavior on perovskite/silicon tandem solar cells by demonstrating their open-circuit voltages and fill factors to remain at 1950 mV and 81% respectively, over eight repeated processes using the same sublimed C60 source material. Notably, one of these cells achieved a certified power conversion efficiency of 30.9%. These findings provide insights crucial for the advancement of perovskite photovoltaic technologies towards scaled production with high process yield.

Defect Pair Formation in FAPbI3 Perovskite Solar Cell Absorbers.

Formamidinium lead iodide (FAPbI3) based hybrid perovskite light absorbers have shown remarkable performance in recent years. Since they have unique set of optoelectronic characteristics, they are considered as a good candidate absorber material for future solar cell applications. Until recently, much research had focused on the quantitative analysis of point defects on halide-based perovskite solar cells. Studies show that understanding defect mechanisms in perovskites has a huge impact on efficiency and stability improvements; however, such mechanisms have not been fully understood yet. Here, using first-principles calculations, we investigate the possible defect pair formations in FAPbI3, characterized by their formation energies and charge transitions. We found that while some donor and acceptor point defects are unstable and shallow when they are isolated, they form stable and deep-trap defect pairs and potentially limit the optoelectronic performance. We anticipate that our results will influence future discussions on the impact of defect formation on the performance and stability of perovskite solar cells.

Strain-enhanced Dzyaloshinskii-Moriya interaction at Co/Pt interfaces.

The interfacial Dzyaloshinskii-Moriya interaction (DMI) is an essential ingredient for stabilizing chiral spin configurations in spintronic applications. Here, via first-principles calculations, we reveal the influence of lattice strain on DMI in Co/Pt interface. We observed a considerable enhancement for a certain lattice strain. Furthermore, a direct correlation is established between the DMI and interlayer distances dominated by the strain, which is attributed to a hybridization of electronic orbitals. This hybridization has also been presented as the microscopic origin of the interfacial DMI. We anticipate that our predictions provide new insights into the control of interfacial DMI for skyrmion-based spintronic devices.