In
this work, we synthesized trifluoromethyl group series modified
triphenylamine dibenzofulvenes, named as CC-1–3, as a hole transporting interfacial layer to obtain well-matched
energy levels and long-term stability features in NiOx-based
inverted perovskite solar cells. The optical and thermal properties
of these new compounds were investigated. All the compounds were combined
with NiOx and formed layer by layer as hole transporting
layers (HTLs). The morphology, energy level, and charge transfer resistance
were all compared. The NiOx/CC-3 bilayer-based
architecture improved the energy level alignment, film morphology,
crystallinity, and hole transportation, allowing for a high-quality
perovskite layer and interfacial contact behavior. As a result, this
inverted cell significantly improved open-circuit voltage (V
OC), short current density (J
SC), fill factor (FF), and power conversion efficiency
(PCE) values up to 21.66 mA cm–2, 1.105 V, 79.33%,
and 19.82%, respectively. Remarkably, the NiOx/CC-3 device had negligible hysteresis and long-term stability, retaining
over 90% of its original efficiencies under argon and over 80% in
the ambient atmosphere after 40 days. This paper shows a new chemical
design, particularly for the trifluoromethyl group effect, and a complete
understanding of the bilayer HTL technique and its promise for producing
efficient cell performance.