Self-Regulated Bilateral Anchoring Enables Efficient Charge Transport Pathways for High-Performance Rigid and Flexible Perovskite Solar Cells

Published in Chemistry and Materials

Self-Regulated Bilateral Anchoring Enables Efficient Charge Transport Pathways for High-Performance Rigid and Flexible Perovskite Solar Cells
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Self-Regulated Bilateral Anchoring Enables Efficient Charge Transport Pathways for High-Performance Rigid and Flexible Perovskite Solar Cells - Nano-Micro Letters

Interface modification has been demonstrated as an effective means to enhance the performance of perovskite solar cells. However, the effect depends on the anchoring mode and strength of the interfacial molecules, which determines whether long-term robust interface for carrier viaduct can be achieved under operational light illumination. Herein, we select squaric acid (SA) as the interfacial molecule between the perovskite and SnO2 layer and propose a self-regulated bilateral anchoring strategy. The unique four-membered ring conjugated structure and dicarboxylic acid groups facilitate stable hydrogen bonds and coordination bonds at both SnO2/SA and SA/PbI2 interfaces. The self-transforming property of SA enables the dynamic bilateral anchoring at the buried interface, ultimately releasing residual stress and constructing a stable interfacial molecular bridge. The results show that SA molecular bridge not only can effectively inhibit the generation of diverse charged defects but also serves as an effective electron transport pathway, resulting in improved power conversion efficiency (PCE) from 23.19 to 25.50% and excellent stability at the maximum power point. Additionally, the PCEs of the flexible and large-area (1 cm2) devices were increased to 24.92% and 24.01%, respectively, demonstrating the universal applicability of the bilateral anchoring to PSCs based on different substrates and larger area.

As perovskite solar cells (PSCs) approach commercialization, the buried electron-transport interface remains a hidden source of efficiency loss and long-term instability. Now researchers from Dalian Jiaotong University, Dalian University of Technology and CAS Hefei Institutes, led by Prof. Guozhen Liu, Prof. Zhihua Zhang and Prof. Xu Pan, introduce a one-molecule, self-regulated “bilateral anchoring” strategy that turns this buried weakness into a performance booster. Their work, published in Nano-Micro Letters, delivers record efficiencies for both rigid and flexible PSCs while extending device lifetime under real-world stress.

Why the Buried Interface Matters

  • Defect Hot-Spot: Oxygen vacancies in SnO2 and under-coordinated Pb2+/halide defects at the perovskite side trap carriers and lower open-circuit voltage.
  • Energy-Level Mis-Match: Poor band alignment impedes electron extraction and invites recombination.
  • Mechanical Stress: Residual tensile stress accelerates crack formation when devices are heated or bent.
  • Solvent Instability: Conventional modifiers dissolve during perovskite casting, losing activity before the film even dries.

Innovative Design and Features

  • Squaric Acid (SA) Molecular Bridge: A four-membered, self-transforming ring delivers two carboxylic acid sites that simultaneously H-bond to SnO2 and coordinate Pb2+, creating a solvent-proof, dual-sided anchor.
  • Dynamic Stress Release: SA’s quasi-aromatic backbone expands/contracts during thermal processing, converting 24.6 MPa tensile stress into −17 MPa beneficial compression in the perovskite lattice.
  • Defect-Healing & Mobility Boost: DFT shows formation energies of VFA, VI, VPb and VO rise by 0.1–1.2 eV after SA bonding; SCLC mobility climbs from 3.22 × 10-3 to 5.88 × 10-3 cm2 V-1 s-1.
  • Universal Applicability: Process is compatible with spin, blade or slot-die coating on glass, PEN or stainless-steel foils.

Applications and Future Outlook

  • High-Efficiency Devices: Champion rigid cells deliver 25.50 % PCE (Voc 1.19 V, Jsc 25.47 mA cm-2, FF 84.3 %); flexible cells reach 24.92 % with only 1.57 % hysteresis.
  • Large-Area Viability: 1 cm2 rigid modules still yield 24.01 %, proving scalability.
  • Multistress Stability: Un-encapsulated films retain >90 % of peak output after 3840 h at 45 ± 5 % RH, 88 % after 528 h at 85 °C, and 88 % after 1700 h continuous 1-sun MPP tracking; flexible devices survive 10 000 bends at 5 mm radius with <10 % loss.
  • Industrial Roadmap: Team is transferring the SA interlayer to roll-to-roll PEN lines and 30 × 30 cm2 minimodules, targeting IEC 61215 certification within two years.

This work establishes squaric acid as a commercially viable, single-component modifier that unites defect passivation, stress management and energy-level tuning—offering a clear pathway toward >25 % stable PSCs on any substrate. Stay tuned for pilot-line results from Prof. Liu, Prof. Zhang and Prof. Pan’s joint laboratories!

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Perovskites
Physical Sciences > Materials Science > Materials for Energy and Catalysis > Perovskites
Solar Cells
Physical Sciences > Chemistry > Physical Chemistry > Photochemistry > Photovoltaics > Solar Cells
Materials for Energy and Catalysis
Physical Sciences > Materials Science > Materials for Energy and Catalysis
Surfaces, Interfaces and Thin Film
Physical Sciences > Materials Science > Surfaces, Interfaces and Thin Film
Electron Transfer
Physical Sciences > Chemistry > Physical Chemistry > Electron Transfer
  • Nano-Micro Letters Nano-Micro Letters

    Nano-Micro Letters is a peer-reviewed, international, interdisciplinary and open-access journal that focus on science, experiments, engineering, technologies and applications of nano- or microscale structure and system in physics, chemistry, biology, material science, and pharmacy.